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Key Documents

W368903

Sigma-Aldrich

cis-3-Hexenyl cis-3-hexenoate

≥95%, stabilized, FG

Synonym(s):

(Z)-3-hexen-1-yl (Z)-3-hexenoate

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About This Item

Linear Formula:
C2H5CH=CHCH2CO2CH2CH2CH=CHC2H5
CAS Number:
Molecular Weight:
196.29
FEMA Number:
3689
EC Number:
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.291
NACRES:
NA.21

biological source

synthetic

Quality Level

grade

FG
Fragrance grade
Halal
Kosher

agency

follows IFRA guidelines

reg. compliance

EU Regulation 1223/2009
EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 110

assay

≥95%

contains

alpha-tocopherol, synthetic as stabilizer

refractive index

n20/D 1.452 (lit.)

bp

60 °C/0.5 mmHg (lit.)

density

0.907 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

organoleptic

fresh; green; fruity; ethereal; pear

SMILES string

[H]\C(CC)=C(/[H])CCOC(=O)C\C([H])=C(\[H])CC

InChI

1S/C12H20O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5-8H,3-4,9-11H2,1-2H3/b7-5-,8-6-

InChI key

UZJQQWFHPLYECS-SFECMWDFSA-N

Storage Class

10 - Combustible liquids

wgk_germany

WGK 2

flash_point_f

210.0 °F - closed cup

flash_point_c

98.90 °C - closed cup

ppe

Eyeshields, Gloves


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