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586374

Sigma-Aldrich

4-Chlorobenzoylacetonitrile

97%

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About This Item

Linear Formula:
ClC6H4COCH2CN
CAS Number:
4640-66-8
Molecular Weight:
179.60
MDL number:
MFCD00051625
UNSPSC Code:
12352100
PubChem Substance ID:
24881116
NACRES:
NA.22

Quality Level

100

assay

97%

form

solid

mp

129-133 °C (lit.)

functional group

chloro
ketone
nitrile

SMILES string

Clc1ccc(cc1)C(=O)CC#N

InChI

1S/C9H6ClNO/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4H,5H2

InChI key

JYOUFPNYTOFCSJ-UHFFFAOYSA-N

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

ppe

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
MKCR3835
MKCG7287
MKCF2156
MKCC4697
MKBW5029V

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