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Key Documents

Safety Information

W393600

Sigma-Aldrich

cis-3-Hexenyl valerate

mixture of isomers, natural (US), ≥97%, FG

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About This Item

Empirical Formula (Hill Notation):
C11H20O2
CAS Number:
Molecular Weight:
184.28
FEMA Number:
3936
EC Number:
Council of Europe no.:
10686
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.571
Organoleptic:
green; tropical; fruity
grade:
FG
Fragrance grade
Kosher
natural (US)
biological source:
botanical
Agency:
follows IFRA guidelines
food allergen:
no known allergens

biological source

botanical

Quality Level

grade

FG
Fragrance grade
Kosher
natural (US)

Agency

follows IFRA guidelines

reg. compliance

EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002

Assay

≥97%

refractive index

n20/D 1.435

density

0.882 g/mL at 25 °C

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

Organoleptic

green; tropical; fruity

SMILES string

CCCCC(=O)OCC\C=C/CC

InChI

1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h5,7H,3-4,6,8-10H2,1-2H3/b7-5-

InChI key

XPFTVTFOOTVHIA-ALCCZGGFSA-N

Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

170.0 °F

Flash Point(C)

76.67 °C

Regulatory Information

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