Allyl isothiocyanate
Allyl isothiocyanate is listed in Annex II as a prohibited substance for cosmetic products placed on the EU market.
Chemical identity and properties

Allyl Isothiocyanate
Allyl isothiocyanate is an isothiocyanate with the formula CH2=CHCH2N=C=S. A colorless oil with boiling point 152C, it is responsible for the pungent taste of mustard, horseradish, and wasabi. It has a role as a metabolite, an antimicrobial agent, an antineoplastic agent, an apoptosis inducer and a lachrymator. It is an alkenyl isothiocyanate and an isothiocyanate. — ChEBI
- IUPAC name
- 3-isothiocyanatoprop-1-ene
- Molecular formula
- C4H5NS
- Molecular weight
- 99.16 g/mol
- Exact mass
- 99.01427034 Da
- XLogP3
- 2.4
- Topological polar surface area
- 44.5 Ų
- Hydrogen-bond donors
- 0
- Hydrogen-bond acceptors
- 2
- Covalent units
- 1
- Defined stereocentres
- 0
Also known as
16 more reported names
External database identifiers
- ChEBI:CHEBI:73224
- ChEMBL:CHEMBL233248
- EPA DTXSID:DTXSID3020047
- PubMed:37375837
- PubMed:37318315
- PubMed:36693442
- PubMed:34635025
- PubMed:31944254
- PubMed:30927557
- PubMed:30738091
- PubMed:30636360
- PubMed:29111112
- PubMed:29054683
- PubMed:28483571
- PubMed:27738742
Retrieved from NIH PubChem on 2026-08-31 by checksum-valid CAS matching. Chemical properties do not replace the regulatory decision on this page.
Record details
Chemical name
Allyl isothiocyanate
Regulatory information
Key data
Related records for Allyl isothiocyanate
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What Annex II means for Allyl isothiocyanate
Allyl isothiocyanate is listed as a prohibited substance under Annex II of EU Cosmetics Regulation 1223/2009 and must not be intentionally added. Article 17 separately addresses unintended small quantities that are technically unavoidable under good manufacturing practice and compatible with the Article 3 safety requirement.
Formulators must screen their ingredients and raw materials to ensure none contain this substance. Suppliers should provide documentation confirming absence when requested.
The page also surfaces 12 related annex records with overlapping identifiers, annex logic or naming patterns.
Compliance checklist
- Verify this substance is absent from all raw materials and finished formulations.
- Request absence confirmation or CoA from raw material suppliers.
- Document the screening result in the Product Information File (PIF).
Frequently asked questions
Source note for Annex II record Allyl isothiocyanate
This page summarizes one Annex II record for Allyl isothiocyanate from public European Commission cosmetic materials and adds linked inventory or identifier matches when available.
Use this record page to review Annex II conditions for Allyl isothiocyanate, but confirm any final regulatory decision against the current official annex wording and source files.
Tools & next steps
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