ChemicalBook--->CAS DataBase List--->37774-78-0

37774-78-0

37774-78-0 Structure

37774-78-0 Structure
IdentificationBack Directory
[Name]

2-Cyanobenzophenone
[CAS]

37774-78-0
[Synonyms]

2-CYANOBENZOPHENONE
2-CYANOBENZOPHENONE 97
Benzonitrile, 2-benzoyl-
[Molecular Formula]

C14H9NO
[MDL Number]

MFCD00672032
[MOL File]

37774-78-0.mol
[Molecular Weight]

207.23
Chemical PropertiesBack Directory
[Melting point ]

82-87 °C (lit.)
[Boiling point ]

215-225 °C(Press: 20 Torr)
[density ]

1.19±0.1 g/cm3(Predicted)
[InChI]

1S/C14H9NO/c15-10-12-8-4-5-9-13(12)14(16)11-6-2-1-3-7-11/h1-9H
[InChIKey]

XPBIJHFBORWDCM-UHFFFAOYSA-N
[SMILES]

O=C(c1ccccc1)c2ccccc2C#N
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

2-Cyanobenzophenone (2-benzoylbenzonitrile) may be used in the preparation of 3-phenyl-3H-isobenzofuran-1-ylidenamine.
[General Description]

2-Cyanobenzophenone, also known as 2-benzoylbenzonitrile, is a carbonyl-ene-nitrile compound. Its crystal structure belongs to the monoclinic space group, P21/c. 2-Cyanobenzophenone reacts with furan to form the corresponding adduct. Its reduction under electrochemical condition led to the formation of 2-t-butylbenzophenone, 3-t-butyl-3-phenylphthalide and 6-t-butyl-3-phenylphthalide.
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