ChemicalBook--->CAS DataBase List--->1198-97-6

1198-97-6

1198-97-6 Structure

1198-97-6 Structure
IdentificationBack Directory
[Name]

4-Phenyl-2-pyrrolidinone
[CAS]

1198-97-6
[Synonyms]

4-phenylpyrrolidone-2
4-Phenyl-2-pyrrolidone
4-PHENYL-2-PYRIOLIDONE
4-phenyl-2-pyrrolidinon
4-phenylpyrrolidin-2-one
4-PHENYL-2-PYRROLIDINONE
[Molecular Formula]

C10H11NO
[MDL Number]

MFCD01687226
[MOL File]

1198-97-6.mol
[Molecular Weight]

161.2
Chemical PropertiesBack Directory
[Melting point ]

72.0~78.0℃
[Boiling point ]

287.51°C (rough estimate)
[density ]

1.0840 (rough estimate)
[refractive index ]

1.5200 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

16.13±0.40(Predicted)
[color ]

Off-White to Pale Yellow
[InChI]

InChI=1S/C10H11NO/c12-10-6-9(7-11-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)
[InChIKey]

HOJZEMQCQRPLQQ-UHFFFAOYSA-N
[SMILES]

N1CC(C2=CC=CC=C2)CC1=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319-H315
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
[HS Code ]

2933998090
Hazard InformationBack Directory
[Uses]

is used in the preparation of oxotremorine analogs as muscarinic antagonists. Also used in the synthesis of purrolidinylidemeureas as agents that act on the CNS.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Phenyl-2-pyrrolidinone(1198-97-6)MS
4-Phenyl-2-pyrrolidinone(1198-97-6)IR1
4-Phenyl-2-pyrrolidinone(1198-97-6)IR2
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