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249440

Hydrocinnamoyl chloride

98%

Synonym(s):

3-Phenylpropionyl chloride

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About This Item

Linear Formula:
C6H5CH2CH2COCl
CAS Number:
645-45-4
Molecular Weight:
168.62
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24854993
EC Number:
211-443-6
Beilstein/REAXYS Number:
742586
MDL number:
MFCD00000748
Assay:
98%
Form:
liquid
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Quality Segment

assay

98%

form

liquid

refractive index

n20/D 1.5265 (lit.)

bp

107 °C/11 mmHg (lit.)

mp

−7-−5 °C (lit.)

density

1.135 g/mL at 25 °C (lit.)

functional group

acyl chloride, phenyl

SMILES string

ClC(=O)CCc1ccccc1

InChI

1S/C9H9ClO/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2

InChI key

MFEILWXBDBCWKF-UHFFFAOYSA-N

General description

Reduction of hydrocinnamoyl chloride at mercury cathodes in acetonitrile containing tetraalkylammonium perchlorates has been investigated by cyclic voltammetry.

Application

Hydrocinnamoyl chloride has been used in:
  • enantioselective synthesis of the antifouling agent, (+)-maculalactone A
  • synthesis of hydrocinnamoyl-farnesyl-L-cysteine methyl ester

Pictograms

Skull and crossbones
GHS06

Signal Word

Danger

Hazard Codes

H315,H331,H412

Hazard Classifications

Acute Tox. 3 Inhalation - Aquatic Chronic 3 - Skin Irrit. 2

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

PPE (personal protective equipment)

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

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