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Structure

7-Chloro-1-(4-cyanophenyl)-1-oxoheptane

CAS
898786-22-6
Catalog Number
ACM898786226
Category
Other Products
Molecular Weight
249.74
Molecular Formula
C14H16ClNO

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Specification

Synonyms
7-CHLORO-1-(4-CYANOPHENYL)-1-OXOHEPTANE
IUPAC Name
4-(7-chloroheptanoyl)benzonitrile
Canonical SMILES
C1=CC(=CC=C1C#N)C(=O)CCCCCCCl
InChI Key
WPZQSCWEQUTGQR-UHFFFAOYSA-N
Boiling Point
412.4ºC at 760 mmHg
Flash Point
203.2ºC
Density
1.11g/cm³
Exact Mass
249.09200
H-Bond Acceptor
2
H-Bond Donor
0
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