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Key Documents

W340210

Sigma-Aldrich

cis-3-Hexenyl butyrate

natural, ≥95%, FG

Synonym(s):

(Z)-3-hexen-1-yl butyrate, Leaf butyrate, [(Z)-hex-3-enyl] butanoate

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About This Item

Linear Formula:
CH3CH2CH2CO2CH2CH2CH=CHC2H5
CAS Number:
Molecular Weight:
170.25
FEMA Number:
3402
EC Number:
MDL number:
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.270
NACRES:
NA.21

grade

FG
Kosher
natural

Quality Level

Agency

meets purity specifications of JECFA

reg. compliance

EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117

Assay

≥95%

refractive index

n20/D 1.431 (lit.)

bp

96 °C/20 mmHg (lit.)

density

0.885 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

fresh; green; vegetable; fruity

SMILES string

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

InChI

1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5-

InChI key

ZCHOPXVYTWUHDS-WAYWQWQTSA-N

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Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

174.2 °F - closed cup

Flash Point(C)

79 °C - closed cup


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The dynamics of plant volatile (PV) emission, and the relationship between damaged area and biosynthesis of bioactive molecules in plant-insect interactions, remain open questions. Direct Contact-Sorptive Tape Extraction (DC-STE) is a sorption sampling technique employing non adhesive polydimethylsiloxane tapes, which

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