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Structure

Methyl 2-chloro-alpha-cyanohydrocinnamate

CAS
7346-46-5
Catalog Number
ACM7346465
Category
Other Products
Molecular Weight
223.66
Molecular Formula
C11H10ClNO2

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Specification

Synonyms
CID688146, NSC122542, ZINC00056765, 7346-46-5, InChI=1/C11H10ClNO2/c1-15-11(14)9(7-13)6-8-4-2-3-5-10(8)12/h2-5,9H,6H2,1H
IUPAC Name
methyl (2S)-3-(2-chlorophenyl)-2-cyanopropanoate
Canonical SMILES
COC(=O)C(CC1=CC=CC=C1Cl)C#N
InChI Key
UINYMUPWCAHBKX-VIFPVBQESA-N
Boiling Point
126-127ºC0.75 mm Hg(lit.)
Melting Point
55-57ºC(lit.)
Flash Point
172.3ºC
Density
1.235g/cm³
Exact Mass
223.04000
Hazard Statements
Xn
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
26-36
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