AG000POJ

1198-97-6 | 2-Pyrrolidinone, 4-phenyl-

AG000POJ

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CAS Number	1198-97-6
Catalog Number	AG000POJ(AGN-PC-0JLNHR)
Chemical Name	2-Pyrrolidinone, 4-phenyl-
IUPAC Name	4-phenylpyrrolidin-2-one
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)
InChI Key	HOJZEMQCQRPLQQ-UHFFFAOYSA-N
MDL Number	MFCD01687226
Molecular Formula	C10H11NO
Molecular Weight	161.2004
SMILES	C2=C(C1CC(=O)NC1)C=CC=C2
Synonyms	4-phenylpyrrolidone-2, 4-Phenyl-2-pyrrolidone, 1198-97-6, 4-phenylpyrrolidin-2-one, 4-Phenyl-2-pyrrolidinone, Phenylpyrrolidone, 4-Phenylpyrrolidone-2, 2-Pyrrolidinone, 4-phenyl-, 4-Phenyl-pyrrolidin-2-one, CHEMBL286419, HOJZEMQCQRPLQQ-UHFFFAOYSA-N, 3-phenyl-3,4-dihydro-2H-pyrrol-5-ol, F2147-0209, 71657-88-0, 4-phenyl-2-pyriolidone, 4-phenyl-2-pyrrolidinon, ChemDiv2_001857, AC1L3SP1, AC1Q6M5V, MLS000762405, SCHEMBL531338, CTK8B5664, 4-PHENYL-2-PYROLLIDINONE, HMS1374E09, HMS2800K04, BCP05253, KS-00000E0W, ANW-49506, BDBM50017106, CP-585, MFCD01687226, RW3668, STK006864, STL191081, AKOS001683714, AKOS016050334, AKOS016402939, AB09758, CS-W018637, FS-3278, MCULE-4630950069, QC-2398, RP22435, NCGC00246500-01, AK-23788, AM803027, AN-48856, BC225335, BR-23788, SMR000437921, SY031841, AB0035126, LS-138961, ST2411592, TR-003311, 4CH-000425, FT-0648273, ST45026099, X9402, MFCD01687226 (95%), S-4116, 198P976, J-515937, (R)-4-Phenylpyrrolidin-2-one, C10H11NO, (S)-4-PHENYLPYRROLIDIN-2-ONE, C10-H11-N-O, AR-1G4440, CID121397, ACN-030020, 2-hydroxy-2-(4-hydroxyphenyl)acetic acid, rac-4-Phenyl-pyrrolidin-2-one, 98% - 1G 1g, 62624-45-7, 12039-14-4,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.084g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	161.204g/mol
Monoisotopic Mass	161.084g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number