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Home >> Chemical Listing >> Page 2929 >> 2-(3,3-Dimethylbutanoyl)benzonitrile

2-(3,3-Dimethylbutanoyl)benzonitrile
[CAS# 898764-17-5]

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Identification
Name 2-(3,3-Dimethylbutanoyl)benzonitrile
Synonyms 2'-Cyano-3,3-dimethylbutyrophenone
Molecular Structure CAS#: 898764-17-5, 2-(3,3-Dimethylbutanoyl)benzonitrile
Molecular Formula C13H15NO
Molecular Weight 201.26
CAS Registry Number 898764-17-5
SMILES N#Cc1ccccc1C(=O)CC(C)(C)C
InChI 1S/C13H15NO/c1-13(2,3)8-12(15)11-7-5-4-6-10(11)9-14/h4-7H,8H2,1-3H3
InChIKey OYQMSIHPSQKJMX-UHFFFAOYSA-N
Properties
Density 1.027g/cm3 (Cal.)
Boiling point 326.739°C at 760 mmHg (Cal.)
Flash point 151.407°C (Cal.)
Refractive index 1.516 (Cal.)
Safety Data
SDS Available
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