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7-Chloro-1-(3-cyanophenyl)-1-oxoheptane

CAS
898786-76-0
Catalog Number
ACM898786760
Category
Other Products
Molecular Weight
249.74
Molecular Formula
C14H16ClNO
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Specification

Synonyms
7-CHLORO-1-(3-CYANOPHENYL)-1-OXOHEPTANE
IUPAC Name
3-(7-chloroheptanoyl)benzonitrile
Canonical SMILES
C1=CC(=CC(=C1)C(=O)CCCCCCCl)C#N
InChI Key
DTEWSADGBKJKNW-UHFFFAOYSA-N
Boiling Point
398.4ºC at 760 mmHg
Flash Point
194.8ºC
Density
1.11g/cm³
Exact Mass
249.09200
H-Bond Acceptor
2
H-Bond Donor
0
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