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CAS 2035-99-6

CAS 2035-99-6 matches 0 EU annex records across Annex II–VI of Regulation 1223/2009.

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Chemical identity and properties

PubChem 2D chemical structure for CAS 2035-99-6
CAS 2035-99-6PubChem CID 16255

3-Methylbutyl octanoate

3-methylbutyl octanoate is a fatty acid ester obtained by the formal condensation of isoamylol with caprylic acid. It has a role as a metabolite. It is functionally related to an isoamylol and an octanoic acid. — ChEBI

IUPAC name
3-methylbutyl octanoate
Molecular formula
C13H26O2
Molecular weight
214.34 g/mol
Exact mass
214.193280068 Da
XLogP3
4.8
Topological polar surface area
26.3 Ų
Hydrogen-bond donors
0
Hydrogen-bond acceptors
2
Covalent units
1
Defined stereocentres
0

Also known as

Isopentyl octanoateIsoamyl octanoateIsoamyl caprylateOctanoic acid, 3-methylbutyl esterIsoamyl octanoate (natural)octanoic acid isopentyl esterEINECS 218-004-8UNII-2EX40079OL
16 more reported names
BRN 1767760AI3-018272EX40079OLWE(4:0(3Me)/8:0)ISOAMYL OCTANOATE [FHFI]CHEBI:87536FEMA 20804-02-00-00988 (Beilstein Handbook Reference)OCTANOIC ACID, ISOPENTYL-ESTERIsoamyl caprylic acidIsoamyl octanoic acidIsopentyl octanoic acidRefChem:94853Octanoate isopentyl ester3-Methylbutyl octanoic acidXKWSWANXMRXDES-UHFFFAOYSA-N
Open full PubChem recordPubChem annotations3D structure image
External database identifiers

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

Records for CAS 2035-99-6

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How CAS 2035-99-6 is used on this site

CAS 2035-99-6 is the Chemical Abstracts Service identifier used to pin this page to a specific substance. In the current dataset, 0 EU annex records share this identifier, which helps you cross-check whether the same substance appears under one regulatory context or several.

Use this page when a supplier specification, SDS or raw-material dossier gives you CAS 2035-99-6 and you need to see every linked Annex II–VI record in one place. The entry cards above are the quickest route to concentration limits, warnings, annex placement and product-type conditions.