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4-(6-Cyanohexanoyl)benzonitrile
[CAS# 898767-54-9]

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Identification
Name 4-(6-Cyanohexanoyl)benzonitrile
Synonyms 7-(4-cyanophenyl)-7-oxoheptanenitrile
Molecular Structure CAS#: 898767-54-9, 4-(6-Cyanohexanoyl)benzonitrile
Molecular Formula C14H14N2O
Molecular Weight 226.27
CAS Registry Number 898767-54-9
SMILES N#Cc1ccc(cc1)C(=O)CCCCCC#N
InChI 1S/C14H14N2O/c15-10-4-2-1-3-5-14(17)13-8-6-12(11-16)7-9-13/h6-9H,1-5H2
InChIKey TUVNSXKUZCLSIB-UHFFFAOYSA-N
Properties
Density 1.1g/cm3 (Cal.)
Boiling point 448.656°C at 760 mmHg (Cal.)
Flash point 225.139°C (Cal.)
Refractive index 1.532 (Cal.)
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