Permitted list with conditionsBinding ruleASEANOriginal is EnglishOfficial-source import checked

Salts of benzoic acid other than that listed under reference number 1 and esters of benzoic acid Ammonium benzoate (CAS No.1863-63- 4)/ Calcium benzoate (CAS No. 2090-05-3)/ Potassium benzoate (CAS No. 582-25-2)/ Magnesium benzoate (CAS No. 553-70- 8)/ MEA- benzoate (CAS No. 4337-66-0)/ Methyl benzoate (CAS No. 93-58-3) / Ethyl benzoate (CAS No. 93-89-0)/ Propyl benzoate (CAS No. 92315-68-6)/ Butyl benzoate (CAS No. 136-60-7) / Isobutyl benzoate (CAS No. 120-50-3)/ Isopropyl benzoate (CAS No. 939-48-0)/ Phenyl benzoate (CAS No. 93-99-2)

Salts of benzoic acid other than that listed under reference number 1 and esters of benzoic acid Ammonium benzoate (CAS No.1863-63- 4)/ Calcium benzoate (CAS No. 2090-05-3)/ Potassium benzoate (CAS No. 582-25-2)/ Magnesium benzoate (CAS No. 553-70- 8)/ ME

ASEAN Annex VI lists this record among preservatives allowed for cosmetic use. Member-state transition rules and deviations still require local verification.

Regulatory decision and full conditions

Status
Permitted list with conditions
Legal role
Binding rule
Regulatory summary
ASEAN Annex VI lists this record among preservatives allowed for cosmetic use. Member-state transition rules and deviations still require local verification.
Conditions and restrictions
0.5 % (acid)

Substance identity

Official source name
Salts of benzoic acid other than that listed under reference number 1 and esters of benzoic acid Ammonium benzoate (CAS No.1863-63- 4)/ Calcium benzoate (CAS No. 2090-05-3)/ Potassium benzoate (CAS No. 582-25-2)/ Magnesium benzoate (CAS No. 553-70- 8)/ MEA- benzoate (CAS No. 4337-66-0)/ Methyl benzoate (CAS No. 93-58-3) / Ethyl benzoate (CAS No. 93-89-0)/ Propyl benzoate (CAS No. 92315-68-6)/ Butyl benzoate (CAS No. 136-60-7) / Isobutyl benzoate (CAS No. 120-50-3)/ Isopropyl benzoate (CAS No. 939-48-0)/ Phenyl benzoate (CAS No. 93-99-2)
CAS
1863-63-4; 2090-05-3; 582-25-2; 553-70-8; 4337-66-0; 93-58-3; 93-89-0; 92315-68-6; 136-60-7; 120-50-3; 939-48-0; 93-99-2
EC
217-468-9
Identity mapping
cas_number
Linked ingredient
AMMONIUM BENZOATE

Linked CosIng identity data

Names and aliases

AMMONIUM BENZOATE

CosIng description: Ammonium benzoate

EU inventory restriction note: V/1a

Recorded cosmetic function: PRESERVATIVE

Function pages:PRESERVATIVE

View the complete ingredient profile

Cross-market snapshot for this identity

Exact linked records currently present in this site. An absent market means no imported exact match, not permission to use the substance.

5 market datasets

European Union

Positive-list entry with conditions

1 linked record · 1 with specific conditions

Open supporting record

Great Britain

Permitted list with conditions

1 linked record · 1 with specific conditions

Open supporting record

New Zealand

Permitted list with conditions

11 linked records · 11 with specific conditions

Open supporting record

ASEAN

Current record
Permitted list with conditions

1 linked record · 1 with specific conditions

Open supporting record
PubChem 2D chemical structure for CAS 120-50-3
CAS 120-50-3PubChem CID 61048

Verified chemistry for CAS 120-50-3

Isobutyl Benzoate

IUPAC name
2-methylpropyl benzoate
Molecular formula
C11H14O2
Molecular weight
178.23 g/mol
Exact mass
178.099379685 Da
Monoisotopic mass
178.099379685 Da
XLogP3
3.6
Topological polar surface area
26.3 Ų
Molecular complexity
157.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Rotatable bonds
4
Heavy atoms
13
Covalent units
1

Names and synonyms reported to PubChem

BENZOIC ACID, 2-METHYLPROPYL ESTERBenzoic acid, isobutyl esterFEMA No. 2185KQ6XZ9WJIINSC-6580CHEBI:87500RefChem:791620204-401-3
16 more reported names
Benzoic Acid Isobutyl EsterBenzoic acid-(2-methylpropyl) esterIsobutyl benzoate (natural)Benzoic acid isobutyl2-Methylpropyl Ester Benzoic AcidUNII-KQ6XZ9WJIINSC 6580EINECS 204-401-3BRN 2045961AI3-01267iso-butyl benzoateBENZOIC ACID 2-METHYLPROPYL ESTERIsobutyl benzoate, 99%Benzoic acid, isobutyl ester (6CI,7CI,8CI)Isobutyl benzoate, >=98%(2-methyl-1-propyl) benzoate
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D pharmacophore features
3
3D rings
1
3D hydrophobes
1
3D acceptor features
1
3D donor features
0
3D anionic centres
0
3D cationic centres
0
3D conformers
10
Effective 3D rotors
4.0
Machine-readable structure identifiers
SMILES
CC(C)COC(=O)C1=CC=CC=C1
InChI
InChI=1S/C11H14O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey
KYZHGEFMXZOSJN-UHFFFAOYSA-N

Evidence from additional scientific databases

NIH PubChem PUG-View
Exact identifier match61048

Attributed physical-property, hazard, environmental and use annotations.

  • Note: This chemical does not meet GHS hazard criteria for 100% (1572 of 1572) of all reports. Source: European Chemicals Agency (ECHA)
  • GHS Hazard Statements: Not Classified; Reported as not meeting GHS hazard criteria by 1572 of 1572 companies. For more detailed information, please visit ECHA C&L website. Source: European Chemicals Agency (ECHA)
  • ECHA C&L Notifications Summary: Aggregated GHS information provided per 1572 reports by companies from 1 notifications to the ECHA C&L Inventory.; Reported as not meeting GHS hazard criteria per 1572 of 1572 reports by companies.; There are 0 notifications provided by 0 of 1572 reports by companies with hazard statement code(s).; Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. Source: European Chemicals Agency (ECHA)
  • Cosmetic Ingredient Review Finding(s): Safe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org Source: Cosmetic Ingredient Review (CIR)

Mapped by: Existing checksum-valid CAS to unique PubChem CID match. Retrieved: 2026-08-31. Open source record

Scientific classifications and hazard annotations provide context and do not replace the market-specific regulatory decision shown above.

Additional source coverage and match status
SourceResultChecked
NIH PubChem PUG-ViewExact match2026-08-31

A recorded no-match is useful evidence that the source was checked; it is not a claim that the substance does not exist elsewhere.

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 136-60-7
CAS 136-60-7PubChem CID 8698

Verified chemistry for CAS 136-60-7

Butyl Benzoate

IUPAC name
butyl benzoate
Molecular formula
C11H14O2
Molecular weight
178.23 g/mol
Exact mass
178.099379685 Da
Monoisotopic mass
178.099379685 Da
XLogP3
3.8
Topological polar surface area
26.3 Ų
Molecular complexity
148.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Rotatable bonds
5
Heavy atoms
13
Covalent units
1

Names and synonyms reported to PubChem

n-Butyl benzoateBenzoic acid, butyl esterAnthrapole AZDai Cari XBNBenzoic acid n-butyl esterButylester kyseliny benzooveHSDB 2089Marvanol Carrier BB
16 more reported names
1TGZ0D0O8INSC 8474EINECS 205-252-7UNII-1TGZ0D0O8INSC-8474Butyl ester of benzoic acidButylester kyseliny benzoove [Czech]Hipochem B-3-MBRN 1867073AI3-00521BUTYL BENZOATE [HSDB]N-BUTYL BENZOATE [MI]CHEBI:1560704-09-00-00290 (Beilstein Handbook Reference)nButyl benzoateBenzoic acid nbutyl ester
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D pharmacophore features
3
3D rings
1
3D hydrophobes
1
3D acceptor features
1
3D donor features
0
3D anionic centres
0
3D cationic centres
0
3D conformers
10
Effective 3D rotors
5.0
Machine-readable structure identifiers
SMILES
CCCCOC(=O)C1=CC=CC=C1
InChI
InChI=1S/C11H14O2/c1-2-3-9-13-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3
InChIKey
XSIFPSYPOVKYCO-UHFFFAOYSA-N

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 1863-63-4
CAS 1863-63-4PubChem CID 15830

Verified chemistry for CAS 1863-63-4

Ammonium Benzoate

IUPAC name
azanium benzoate
Molecular formula
C7H9NO2
Molecular weight
139.15 g/mol
Exact mass
139.063328530 Da
Monoisotopic mass
139.063328530 Da
Topological polar surface area
41.1 Ų
Molecular complexity
98.0
Formal charge
0
Hydrogen-bond donors
1
Hydrogen-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10
Covalent units
2

Names and synonyms reported to PubChem

Ammonii benzoasBenzoic acid, ammonium saltVulnoc ABAmmonium benzoicumHSDB 555UNII-AC80WD7GPFNSC 7918EINECS 217-468-9
12 more reported names
AI3-07834Ammonium benzoate [USP]AC80WD7GPFAmmonium benzoate (USP)RefChem:58466217-468-9NSC-7918ammoniumbenzoatazanium;benzoateBenzoic acid, ammonium salt (1:1)TYD-01733DB-044596
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D conformers
0
Machine-readable structure identifiers
SMILES
C1=CC=C(C=C1)C(=O)[O-].[NH4+]
InChI
InChI=1S/C7H6O2.H3N/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);1H3
InChIKey
VWSRWGFGAAKTQG-UHFFFAOYSA-N

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 2090-05-3
CAS 2090-05-3PubChem CID 62425

Verified chemistry for CAS 2090-05-3

Calcium Benzoate

IUPAC name
calcium dibenzoate
Molecular formula
C14H10CaO4
Molecular weight
282.30 g/mol
Exact mass
282.0204996 Da
Monoisotopic mass
282.0204996 Da
Topological polar surface area
80.3 Ų
Molecular complexity
98.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
4
Rotatable bonds
0
Heavy atoms
19
Covalent units
3

Names and synonyms reported to PubChem

Benzoic acid, calcium salt3QDE968MKDBENZOCALOLMONOCALCIUM BENZOATEUNII-3QDE968MKDCALCIUM BENZOATE [FCC]INS NO.213INS-213
16 more reported names
CALCIUM BENZOATE [USP-RS]CALCIUM BENZOATE (E 213)EINECS 218-235-4E-213CALCIUM BENZOATE (USP-RS)E Number: 213RefChem:122766CALCIUM BENZOATE [INCI]218-235-4calcium;dibenzoateBenzoic acid, calcium salt (2:1)CalciumbenzoateC14H10CaO4Benzoic acid calcium saltNSQPPSOSXWOZNH-UHFFFAOYSA-LE213
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D conformers
0
Machine-readable structure identifiers
SMILES
C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Ca+2]
InChI
InChI=1S/2C7H6O2.Ca/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H,8,9);/q;;+2/p-2
InChIKey
NSQPPSOSXWOZNH-UHFFFAOYSA-L

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 4337-66-0
CAS 4337-66-0PubChem CID 20343

Verified chemistry for CAS 4337-66-0

Ethanol, 2-amino-, benzoate (1:1)

IUPAC name
2-hydroxyethylazanium benzoate
Molecular formula
C9H13NO3
Molecular weight
183.20 g/mol
Exact mass
183.08954328 Da
Monoisotopic mass
183.08954328 Da
Topological polar surface area
88.0 Ų
Molecular complexity
108.0
Formal charge
0
Hydrogen-bond donors
2
Hydrogen-bond acceptors
3
Rotatable bonds
1
Heavy atoms
13
Covalent units
2

Names and synonyms reported to PubChem

Ethanol, 2-amino-, benzoate (salt)ZTZ1PN1WPQBenzoic acid, compound with 2-aminoethanol (1:1)RefChem:1084475224-387-2Monoethanolamine benzoate2-hydroxyethylazanium;benzoatebenzoic acid, compound with 2-aminoethanol (1
7 more reported names
Benzoic acid, ethanolamine saltUNII-ZTZ1PN1WPQEINECS 224-387-2Benzenecarboxylic acid, ethanolamine salt2-hydroxyethylammonium benzoate2-Aminoethan-1-ol benzoate salt2-Hydroxyethan-1-aminium benzoate
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D conformers
0
Machine-readable structure identifiers
SMILES
C1=CC=C(C=C1)C(=O)[O-].C(CO)[NH3+]
InChI
InChI=1S/C7H6O2.C2H7NO/c8-7(9)6-4-2-1-3-5-6;3-1-2-4/h1-5H,(H,8,9);4H,1-3H2
InChIKey
WUGCLPOLOCIDHW-UHFFFAOYSA-N

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 553-70-8
CAS 553-70-8PubChem CID 62371

Verified chemistry for CAS 553-70-8

Magnesium Benzoate

IUPAC name
magnesium dibenzoate
Molecular formula
C14H10MgO4
Molecular weight
266.53 g/mol
Exact mass
266.0429505 Da
Monoisotopic mass
266.0429505 Da
Topological polar surface area
80.3 Ų
Molecular complexity
98.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
4
Rotatable bonds
0
Heavy atoms
19
Covalent units
3

Names and synonyms reported to PubChem

Benzoic acid, magnesium saltUNII-K3J0WY6SYWK3J0WY6SYWBenzoic acid magnesium salt (2:1)EINECS 209-045-2MAGNESIUM BENZOATE [MI]RefChem:155168MAGNESIUM BENZOATE [INCI]
7 more reported names
magnesium;dibenzoateMAGNESIUMBENZOATEPJJZFXPJNUVBMR-UHFFFAOYSA-LTox21_302263Benzoic acid, magnesium salt (2:1)CAS-553-70-8DB-052722
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D conformers
0
Machine-readable structure identifiers
SMILES
C1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C(=O)[O-].[Mg+2]
InChI
InChI=1S/2C7H6O2.Mg/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H,8,9);/q;;+2/p-2
InChIKey
PJJZFXPJNUVBMR-UHFFFAOYSA-L

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 582-25-2
CAS 582-25-2PubChem CID 23661960

Verified chemistry for CAS 582-25-2

Potassium Benzoate

IUPAC name
potassium benzoate
Molecular formula
C7H5KO2
Molecular weight
160.21 g/mol
Exact mass
159.99266088 Da
Monoisotopic mass
159.99266088 Da
Topological polar surface area
40.1 Ų
Molecular complexity
108.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Covalent units
2

Names and synonyms reported to PubChem

Benzoic acid, potassium salt763YQN2K7KINS NO.212INS-212E--212RefChem:175422209-481-3potassium;benzoate
16 more reported names
benzoic acid potassiumPotassium benzoate [NF]Benzoic acid potassium saltPotassium benzoate (NF)UNII-763YQN2K7KEINECS 209-481-3POTASSIUM BENZOATE [FCC]POTASSIUM BENZOATE [VANDF]POTASSIUM BENZOATE [USP-RS]Tox21_202747TYD-00848Benzoic acid, potassium salt (1:1)potassium benzene carboxylic acid saltHY-W103932CAS-582-25-2E212
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D conformers
0
Machine-readable structure identifiers
SMILES
C1=CC=C(C=C1)C(=O)[O-].[K+]
InChI
InChI=1S/C7H6O2.K/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H,8,9);/q;+1/p-1
InChIKey
XAEFZNCEHLXOMS-UHFFFAOYSA-M

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 93-58-3
CAS 93-58-3PubChem CID 7150

Verified chemistry for CAS 93-58-3

Methyl Benzoate

Methyl benzoate is a benzoate ester obtained by condensation of benzoic acid and methanol. It has a role as an insect attractant and a metabolite. It is a methyl ester and a benzoate ester. ChEBI

IUPAC name
methyl benzoate
Molecular formula
C8H8O2
Molecular weight
136.15 g/mol
Exact mass
136.052429494 Da
Monoisotopic mass
136.052429494 Da
XLogP3
2.1
Topological polar surface area
26.3 Ų
Molecular complexity
114.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Rotatable bonds
2
Heavy atoms
10
Covalent units
1

Names and synonyms reported to PubChem

benzoic acid methyl esterMethylbenzoateBenzoic acid, methyl esterCloriusMethyl benzenecarboxylateEssence of niobeFEMA No. 2683Methylester kyseliny benzoove
16 more reported names
6618K1VJ9TNSC-9394CHEBI:72775RefChem:6019202-259-7Oxidate leNSC 9394Benzoic acid-methyl esterMethyl ester of benzoic acidMethyl benzoate (natural)CAS-93-58-3CCRIS 5851HSDB 5283EINECS 202-259-7UN2938Methylester kyseliny benzoove [Czech]
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D pharmacophore features
2
3D rings
1
3D hydrophobes
0
3D acceptor features
1
3D donor features
0
3D anionic centres
0
3D cationic centres
0
3D conformers
2
Effective 3D rotors
2.0
Machine-readable structure identifiers
SMILES
COC(=O)C1=CC=CC=C1
InChI
InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey
QPJVMBTYPHYUOC-UHFFFAOYSA-N

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 93-89-0
CAS 93-89-0PubChem CID 7165

Verified chemistry for CAS 93-89-0

Ethyl benzoate

Ethyl benzoate is a benzoate ester obtained by condensation of benzoic acid and ethanol. It is a volatile oil component found in ripe kiwifruit, cranberry juice, and palm kernel oil. It has a role as a volatile oil component, a flavouring agent and a fragrance. It is an ethyl ester and a benzoate ester. ChEBI

IUPAC name
ethyl benzoate
Molecular formula
C9H10O2
Molecular weight
150.17 g/mol
Exact mass
150.068079557 Da
Monoisotopic mass
150.068079557 Da
XLogP3
2.6
Topological polar surface area
26.3 Ų
Molecular complexity
126.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Rotatable bonds
3
Heavy atoms
11
Covalent units
1

Names and synonyms reported to PubChem

Benzoic etherEthyl benzenecarboxylateBenzoic Acid Ethyl EsterBenzoyl ethyl etherEthylester kyseliny benzooveFEMA No. 2422Ethyl benzoate (natural)NSC 8884
16 more reported names
EINECS 202-284-3UNII-J115BRJ15HJ115BRJ15HAI3-01352NSC-8884CHEBI:156074EC 202-284-3RefChem:5808HYDROUS BENZOYL PEROXIDE IMPURITY C (EP IMPURITY)202-284-3Benzoic acid, ethyl esterBenzoic acid-ethyl esterethylbenzoateBENZOIC ACID,ETHYL ESTEREthylester kyseliny benzoove [Czech]Ethyl benzoate, >=99%
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D pharmacophore features
2
3D rings
1
3D hydrophobes
0
3D acceptor features
1
3D donor features
0
3D anionic centres
0
3D cationic centres
0
3D conformers
7
Effective 3D rotors
3.0
Machine-readable structure identifiers
SMILES
CCOC(=O)C1=CC=CC=C1
InChI
InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey
MTZQAGJQAFMTAQ-UHFFFAOYSA-N

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 93-99-2
CAS 93-99-2PubChem CID 7169

Verified chemistry for CAS 93-99-2

Phenyl benzoate

Phenyl benzoate is a benzoate ester obtained by the formal condensation of phenol with benzoic acid. ChEBI

IUPAC name
phenyl benzoate
Molecular formula
C13H10O2
Molecular weight
198.22 g/mol
Exact mass
198.068079557 Da
Monoisotopic mass
198.068079557 Da
XLogP3
3.6
Topological polar surface area
26.3 Ų
Molecular complexity
201.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Covalent units
1

Names and synonyms reported to PubChem

Benzoic acid phenyl esterDiphenylcarboxylateBenzoic acid, phenyl esterPhenol, benzoateDPCateB8A3WVZ590CHEBI:86919NSC-37086
16 more reported names
RefChem:6123202-293-2Phenyl benzoate, 99%2-phenylbenzoateEN300-82943CAS-93-99-2EINECS 202-293-2NSC 37086BRN 1566346UNII-B8A3WVZ590Henyl BenzoateAI3-04731PHENY L BENZOATEWLN: RVORBenzoic acid-phenyl esterFT-0658394
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D pharmacophore features
3
3D rings
2
3D hydrophobes
0
3D acceptor features
1
3D donor features
0
3D anionic centres
0
3D cationic centres
0
3D conformers
10
Effective 3D rotors
3.0
Machine-readable structure identifiers
SMILES
C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2
InChI
InChI=1S/C13H10O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H
InChIKey
FCJSHPDYVMKCHI-UHFFFAOYSA-N

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

PubChem 2D chemical structure for CAS 939-48-0
CAS 939-48-0PubChem CID 13654

Verified chemistry for CAS 939-48-0

Isopropyl Benzoate

IUPAC name
propan-2-yl benzoate
Molecular formula
C10H12O2
Molecular weight
164.20 g/mol
Exact mass
164.083729621 Da
Monoisotopic mass
164.083729621 Da
XLogP3
3.2
Topological polar surface area
26.3 Ų
Molecular complexity
146.0
Formal charge
0
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Rotatable bonds
3
Heavy atoms
12
Covalent units
1

Names and synonyms reported to PubChem

Benzoic acid, isopropyl esterBenzoic acid, 1-methylethyl ester1-Methylethyl benzoateFEMA No. 2932Isopropylester kyseliny benzooveIsopropylester kyseliny benzoove [Czech]EINECS 213-361-6BRN 2044384
16 more reported names
AI3-01132ISOPROPYL BENZOATE [FHFI]1Q2618834NISOPROPYL BENZOATE [INCI]4-09-00-00289 (Beilstein Handbook Reference)BENZOIC ACID ISO-PROPYL ESTERRefChem:792158213-361-6InChI=1/C10H12O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2HBENZOIC ACID ISOPROPYL ESTERiso-propyl benzoateAS-14785(1,1,1,2,3,3,3-2H7)ISOPROPYL BENZOATEIsopropylbenzoateIsopropyUNII-1Q2618834N
External database identifiers
Advanced structure statistics
Defined atom stereocentres
0
Undefined atom stereocentres
0
Defined bond stereocentres
0
Undefined bond stereocentres
0
3D pharmacophore features
3
3D rings
1
3D hydrophobes
1
3D acceptor features
1
3D donor features
0
3D anionic centres
0
3D cationic centres
0
3D conformers
10
Effective 3D rotors
3.0
Machine-readable structure identifiers
SMILES
CC(C)OC(=O)C1=CC=CC=C1
InChI
InChI=1S/C10H12O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey
FEXQDZTYJVXMOS-UHFFFAOYSA-N

Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.

Official source and provenance

Registered source
ASEAN Cosmetic Directive annexes
Source reference
ASEAN Annex VI, reference 1a
Source record ID
VI-1a
Source version
2026-1
Source language
English
Translation status
Original is English
Source updated
2026-06-22
Snapshot checked
2026-08-30 04:44 UTC
Validation method
pdfplumber ruled-table extraction with per-annex reviewed counts
SHA-256
ffad59f6c01a92c82042c54203ee14969425c2a82bd04c2f4012ff82513e69f1

Registered dataset notes

Dataset coverage
Banned, restricted and positive-list substances under the harmonised ASEAN framework
Authority note
Regional directive; member-state transitions and deviations still require local verification

How this record fits the market dataset

2224
current ASEAN records
247
records marked Permitted list with conditions
2224
records from this source version
1930
market records with CAS identity

Status distribution

Condition text is present on 462 of 2224 current records. An empty condition field is interpreted according to the record type above; it is never converted into an unrestricted-use claim.

ASEAN market context

Complete regional annex dataset

Coverage version: ASEAN Cosmetic Directive annexes 2026-1, 22 June 2026

Annexes II, III, IV, VI and VII covering prohibited, restricted and positive-list substances.

Verification checklist

  1. Search all ACD annexes by name and identifiers.
  2. Apply product type, maximum level and warning conditions.
  3. Confirm the target member state's adoption and transition date.
  4. Complete the local notification and responsible-company requirements.

Official market sources

Verification workflow and record completeness

Before using this result in a compliance decision

  1. Confirm that “Salts of benzoic acid other than that listed under reference number 1 and esters of benzoic acid Ammonium benzoate (CAS No.1863-63- 4)/ Calcium benzoate (CAS No. 2090-05-3)/ Potassium benzoate (CAS No. 582-25-2)/ Magnesium benzoate (CAS No. 553-70- 8)/ MEA- benzoate (CAS No. 4337-66-0)/ Methyl benzoate (CAS No. 93-58-3) / Ethyl benzoate (CAS No. 93-89-0)/ Propyl benzoate (CAS No. 92315-68-6)/ Butyl benzoate (CAS No. 136-60-7) / Isobutyl benzoate (CAS No. 120-50-3)/ Isopropyl benzoate (CAS No. 939-48-0)/ Phenyl benzoate (CAS No. 93-99-2)” and every CAS/EC identifier refer to the material in your supplier specification.
  2. Search all ACD annexes by name and identifiers.
  3. Apply product type, maximum level and warning conditions.
  4. Confirm the target member state's adoption and transition date.
  5. Complete the local notification and responsible-company requirements.
  6. Document the source version and recheck the regulator before manufacture, notification or market placement.

Fields available in this record

  • Official substance nameAvailable
  • CASAvailable
  • ECAvailable
  • Separate condition textAvailable
  • Effective dateNot supplied
  • Snapshot hash and methodAvailable

Questions this page answers

This identity appears on a market positive list for the list function represented by the source record. Confirm that the intended function and product use fall within the list scope and every stated condition.

Positive-list presence is purpose-specific and is not blanket approval for every cosmetic use. Regional annex coverage does not replace member-state implementation dates, notifications or national deviations.

The record cites ASEAN Annex VI, reference 1a, source version 2026-1. Open the official source.

No. CAS helps resolve identity, but jurisdictions can classify the same substance differently and can apply different product scopes, limits, warnings and transition dates.

Stable citation

Salts of benzoic acid other than that listed under reference number 1 and esters of benzoic acid Ammonium benzoate (CAS No.1863-63- 4)/ Calcium benzoate (CAS No. 2090-05-3)/ Potassium benzoate (CAS No. 582-25-2)/ Magnesium benzoate (CAS No. 553-70- 8)/ MEA- benzoate (CAS No. 4337-66-0)/ Methyl benzoate (CAS No. 93-58-3) / Ethyl benzoate (CAS No. 93-89-0)/ Propyl benzoate (CAS No. 92315-68-6)/ Butyl benzoate (CAS No. 136-60-7) / Isobutyl benzoate (CAS No. 120-50-3)/ Isopropyl benzoate (CAS No. 939-48-0)/ Phenyl benzoate (CAS No. 93-99-2). ASEAN Annex VI, reference 1a. ASEAN. Source version 2026-1. CosIng Checker regulatory record: https://cosingchecker.com/regulations/asean/records/4259/

Cite the regulator as the legal authority. This page is a structured evidence index and verification aid, not a substitute for the official text or professional legal assessment.

Interpretation and limits for ASEAN

This identity appears on a market positive list for the list function represented by the source record.

Confirm that the intended function and product use fall within the list scope and every stated condition.

How to interpret the legal role

The cited row forms part of a binding rule or legally incorporated list for this market.

Evidence on this page

  • Recorded outcome: Permitted list with conditions
  • Legal role: Binding rule
  • Source version: 2026-1

What it does not prove

Regional annex coverage does not replace member-state implementation dates, notifications or national deviations.

Further authoritative substance research

These sources can add identity, safety, exposure or hazard context. A link is not evidence that the database contains this exact substance, and none of these sources overrides the market decision above.

Cosmetic Ingredient Review safety assessments

Expert Panel conclusions, assessed ingredient groups, use conditions, dates and report documents

Independent expert review considered by FDA; not a government approval or binding market rule

Research this identity at the source

FDA Global Substance Registration System

UNII identifiers, preferred names, substance types, codes and public substance relationships

Identity registry only; UNII availability does not imply FDA review or approval

Research this identity at the source

ILO/WHO International Chemical Safety Cards

Hazards, symptoms, first aid, storage, incompatibilities and physical properties for covered chemicals

International occupational chemical-safety reference; not cosmetic-use approval

Research this identity at the source

Japan NITE-CHRIP

Chemical identity, Japanese and foreign legal lists, GHS hazards and exposure-related information

Chemical-management evidence; cosmetic status remains governed by the applicable MHLW standard and market rules

Research this identity at the source

NIOSH Pocket Guide to Chemical Hazards

REL, PEL, IDLH, properties, exposure routes, symptoms, target organs, first aid and measurement methods for covered workplace chemicals

US occupational-health guidance and limits; not a cosmetic ingredient decision

Research this identity at the source

OECD eChemPortal

Gateway to authority-owned physical-property, fate, ecotoxicity, toxicity, exposure and GHS records

Discovery gateway; each linked authority remains responsible for its data

Research this identity at the source

US EPA CompTox CTX APIs

API key required for import

DTXSID identity, experimental and predicted properties, toxicity, bioactivity, exposure and environmental data

Scientific and computational evidence; predictions must remain labelled and do not determine cosmetic legality

Research this identity at the source