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3-(7-Cyanoheptanoyl)benzonitrile
[CAS# 898767-66-3]

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Identification
Name 3-(7-Cyanoheptanoyl)benzonitrile
Synonyms 8-(3-cyanophenyl)-8-oxooctanenitrile
Molecular Structure CAS#: 898767-66-3, 3-(7-Cyanoheptanoyl)benzonitrile
Molecular Formula C15H16N2O
Molecular Weight 240.30
CAS Registry Number 898767-66-3
SMILES N#Cc1cccc(c1)C(=O)CCCCCCC#N
InChI 1S/C15H16N2O/c16-10-5-3-1-2-4-9-15(18)14-8-6-7-13(11-14)12-17/h6-8,11H,1-5,9H2
InChIKey JWIGARDAYDEYFO-UHFFFAOYSA-N
Properties
Density 1.083g/cm3 (Cal.)
Boiling point 449.206°C at 760 mmHg (Cal.)
Flash point 225.472°C (Cal.)
Refractive index 1.528 (Cal.)
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