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W378917

Sigma-Aldrich

3-(Methylthio)hexyl acetate

≥97%, FG

Synonym(s):

lychee mercaptan acetate

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About This Item

Empirical Formula (Hill Notation):
C9H18O2S
CAS Number:
Molecular Weight:
190.30
FEMA Number:
3789
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
12.236
NACRES:
NA.21

biological source

synthetic

Quality Level

grade

FG
Halal
Kosher

reg. compliance

EU Regulation 1334/2008 & 872/2012

Assay

≥97%

refractive index

n/D 1.4640

bp

216 °C (lit.)

density

0.985 g/mL at 20 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

green; vegetable; sulfurous

SMILES string

CCCC(CCOC(C)=O)SC

InChI

1S/C9H18O2S/c1-4-5-9(12-3)6-7-11-8(2)10/h9H,4-7H2,1-3H3

InChI key

VIQXICKUKPVFRK-UHFFFAOYSA-N

Related Categories

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Skin Irrit. 2

WGK

WGK 3

Flash Point(F)

168.8 °F

Flash Point(C)

76 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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