ChemicalBook--->CAS DataBase List--->42436-07-7

42436-07-7

42436-07-7 Structure

42436-07-7 Structure
IdentificationMore
[Name]

cis-3-Hexenyl phenylacetate
[CAS]

42436-07-7
[Synonyms]

C3 HEXENYL PHENYL ACETATE
CIS-3-HEXEN-1-YL PHENYLACETATE
CIS-3-HEXENYL PHENYLACETATE
FEMA 3633
PHENYLACETIC ACID CIS-3-HEXEN-1-YL ESTER
3-hexenylester,(z)-benzeneaceticaci
3-hexenylester,(Z)-Benzeneaceticacid
beta,gamma-hexenylalpha-toluate
z-3-hexenylphenylacetate
(Z)-hex-3-enyl phenylacetate
CIS-3-HEXENYL PHENYLACETATE 99+%
Benzeneacetic acid, (3Z)-3-hexenyl ester
3-HEXENYLPHENYLACETATE
(Z)-Hex-3-enylphenylacetat
3-hexenyl ester, (z)-benzeneacetic acid eta,gamma-hexenyl alpha-toluate
Benzeneacetic acid (Z)-3-hexenyl ester
Phenylacetic acid (Z)-3-hexenyl ester
[EINECS(EC#)]

255-826-6
[Molecular Formula]

C14H18O2
[MDL Number]

MFCD00036531
[Molecular Weight]

218.29
[MOL File]

42436-07-7.mol
Chemical PropertiesBack Directory
[Boiling point ]

292-297 °C (lit.)
[density ]

0.992 g/mL at 25 °C(lit.)
[FEMA ]

3633
[refractive index ]

n20/D 1.502(lit.)
[Fp ]

110 °C
[solubility ]

Insoluble in water, solubic in alcohol and oils.
[color ]

Colorless, slightly viscous liquid
[Odor]

at 100.00 %. green rose honey waxy sweet pea tropical kiwi beany
[biological source]

synthetic
[Odor Type]

green
[JECFA Number]

1016
[Major Application]

flavors and fragrances
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C14H18O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h3-7,9-10H,2,8,11-12H2,1H3/b4-3-
[InChIKey]

FJKFIIYSBXHBCT-ARJAWSKDSA-N
[SMILES]

[H]\C(CC)=C(/[H])CCOC(=O)Cc1ccccc1
[LogP]

4.20
[CAS DataBase Reference]

42436-07-7(CAS DataBase Reference)
[NIST Chemistry Reference]

Cis-3-hexenyl phenyl acetate(42436-07-7)
[EPA Substance Registry System]

42436-07-7(EPA Substance)
Safety DataBack Directory
[WGK Germany ]

2
[RTECS ]

CY1630000
[TSCA ]

TSCA listed
[Storage Class]

10 - Combustible liquids
Hazard InformationBack Directory
[Description]

3-Hexenyl phenylacetate has a mild and sweet, green-rose-mossy odor. May be synthesized from phenylacetyl chloride and cis- 3-hexenol with pyridine catalyst in an inert diluent.
[Chemical Properties]

3-Hexenyl phenylacetate has a mild and sweet, green–rose–mossy odor.
[Occurrence]

Reported found in Japanese peppermint oil, spearmint oil and corn mint oil.
[Preparation]

From phenylacetyl chloride and cis-3-hexenol with pyridine catalyst in an inert diluent.
[Taste threshold values]

Taste characteristics at 15 ppm: waxy, green, floral with vegetable and melon nuances
Spectrum DetailBack Directory
[Spectrum Detail]

cis-3-Hexenyl phenylacetate(42436-07-7)MS
cis-3-Hexenyl phenylacetate(42436-07-7)1HNMR
cis-3-Hexenyl phenylacetate(42436-07-7)13CNMR
cis-3-Hexenyl phenylacetate(42436-07-7)IR1
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

42436-07-7(sigmaaldrich)
[TCI AMERICA]

Phenylacetic Acid cis-3-Hexen-1-yl Ester,>95.0%(GC)(42436-07-7)
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