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Merck
CN

A29402

Allylbenzene

98%

Synonym(s):

3-Phenyl-1-propene

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About This Item

Linear Formula:
C6H5CH2CH=CH2
CAS Number:
Molecular Weight:
118.18
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
206-095-7
Beilstein/REAXYS Number:
1098501
MDL number:
Assay:
98%
Form:
liquid
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InChI key

HJWLCRVIBGQPNF-UHFFFAOYSA-N

InChI

1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-5,7-8H,1,6H2

SMILES string

C=CCc1ccccc1

assay

98%

form

liquid

Quality Level

bp

156-157 °C (lit.)

density

0.892 g/mL at 25 °C (lit.)

Related Categories

General description

Allylbenzene, also known as 3-phenylpropene, is an organic compound used as a source of the allyl group in allylation reactions.

pictograms

FlameHealth hazard

signalword

Danger

hcodes

Hazard Classifications

Asp. Tox. 1 - Flam. Liq. 3

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

104.0 °F - closed cup

flash_point_c

40 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

危险化学品
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Eric A Standley et al.
Journal of the American Chemical Society, 135(4), 1585-1592 (2013-01-16)
The synthesis and characterization of the air-stable nickel(II) complex trans-(PCy(2)Ph)(2)Ni(o-tolyl)Cl is described in conjunction with an investigation of its use for the Mizoroki-Heck-type, room temperature, internally selective coupling of substituted benzyl chlorides with terminal alkenes. This reaction, which employs a
J R Idle
Prague medical report, 106(1), 27-38 (2005-07-13)
The typical spices used in winter include nutmeg, cinnamon, clove and anise. These spices contain two groups of chemicals, the allylbenzenes and their isomers, the propenylbenzenes. It was suggested 40 years ago by Alexander Shulgin that these substances act as
Mitsuo Miyazawa et al.
Natural product research, 19(1), 29-36 (2005-02-11)
A methanol extract from Asiasarum heterotropoides showed a suppressive effect of the SOS-including activity on the mutagen 2-amino-3,4-dimethylimidazo[4,5-f]quinoline (MeIQ) in the Salmonella typhimurium TA1535/pSK1002 umu test. The methanol extract was re-extracted with chloroform, butanol, and water. The chloroform fraction showed
Hamid Sadeghian et al.
Journal of enzyme inhibition and medicinal chemistry, 26(2), 238-244 (2010-10-14)
A group of 2-alkoxy-5-methoxyallylbenzene were designed, synthesised and evaluated as potential inhibitors of the soybean 15-lipoxygenase (SLO) on the basis of the eugenol and esteragol structures. Compound 4d showed the best half maximal inhibitory concentration (IC₅₀) for SLO inhibition (IC₅₀ = 5.9 ± 0.6
Chun Yeon Choi et al.
European journal of pharmacology, 576(1-3), 151-159 (2007-08-19)
Isoeugenol, which is a naturally occurring o-methoxyphenol in a variety of foods and essential oils, is known to have anti-inflammatory effects, although the mechanism is not clear. In the present study, we investigated the effect of isoeugenol on NF-kappaB signaling

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