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Home >> Chemical Listing >> Page 2932 >> 3-(4-Cyanobutanoyl)benzonitrile

3-(4-Cyanobutanoyl)benzonitrile
[CAS# 898767-60-7]

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Identification
Name 3-(4-Cyanobutanoyl)benzonitrile
Synonyms 5-(3-cyanophenyl)-5-oxovaleronitrile
Molecular Structure CAS#: 898767-60-7, 3-(4-Cyanobutanoyl)benzonitrile
Molecular Formula C12H10N2O
Molecular Weight 198.22
CAS Registry Number 898767-60-7
SMILES N#Cc1cccc(c1)C(=O)CCCC#N
InChI 1S/C12H10N2O/c13-7-2-1-6-12(15)11-5-3-4-10(8-11)9-14/h3-5,8H,1-2,6H2
InChIKey YNEOODHLLFNBGN-UHFFFAOYSA-N
Properties
Density 1.146g/cm3 (Cal.)
Boiling point 416.036°C at 760 mmHg (Cal.)
Flash point 205.412°C (Cal.)
Refractive index 1.543 (Cal.)
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