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Key Documents

W203501

Sigma-Aldrich

Allyl mercaptan

≥90%

Synonym(s):

2-Propene-1-thiol, Allyl mercaptan

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About This Item

Linear Formula:
CH2=CHCH2SH
CAS Number:
Molecular Weight:
74.14
FEMA Number:
2035
Beilstein:
1697523
EC Number:
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
12.004
NACRES:
NA.21

biological source

synthetic

Quality Level

reg. compliance

FDA 21 CFR 172.515

Assay

≥90%

refractive index

n20/D 1.4765 (lit.)

bp

67-68 °C (lit.)

density

0.898 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

Organoleptic

alliaceous; pungent; sulfurous

SMILES string

SCC=C

InChI

1S/C3H6S/c1-2-3-4/h2,4H,1,3H2

InChI key

ULIKDJVNUXNQHS-UHFFFAOYSA-N

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Related Categories

Other Notes

Suggested uses: coffee, savory, tropical fruits

Disclaimer

For R&D or non-EU Food use. Not for retail sale.

Pictograms

FlameExclamation mark

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 2

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

4.0 °F - closed cup

Flash Point(C)

-15.56 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Silvia Millan et al.
Food chemistry, 339, 127809-127809 (2020-09-03)
Thiols are important natural molecules with diverse functions, ranging from acting as antioxidants that prevent chronic diseases to contributing aromas to foods and beverages. Biological thiols such as glutathione are of particular interest due to their functional roles, which include

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