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Structure

5-(4-Cyanophenyl)-5-oxovaleronitrile

CAS
898767-48-1
Catalog Number
ACM898767481
Category
Other Products
Molecular Weight
198.22
Molecular Formula
C12H10N2O

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Specification

Synonyms
5-(4-CYANOPHENYL)-5-OXOVALERONITRILE
IUPAC Name
4-(4-cyanobutanoyl)benzonitrile
Canonical SMILES
C1=CC(=CC=C1C#N)C(=O)CCCC#N
InChI Key
QODAPABTZAYCQC-UHFFFAOYSA-N
Boiling Point
434.5ºC at 760 mmHg
Flash Point
216.6ºC
Density
1.14g/cm³
Exact Mass
198.07900
H-Bond Acceptor
3
H-Bond Donor
0
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