AG00C6XM

31992-43-5 | 1-(3-Aminophenyl)pyrrolidin-2-one

AG00C6XM

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CAS Number	31992-43-5
Catalog Number	AG00C6XM(AGN-PC-0JUWG2)
Chemical Name	1-(3-Aminophenyl)pyrrolidin-2-one
IUPAC Name	1-(3-aminophenyl)pyrrolidin-2-one
InChI	InChI=1S/C10H12N2O/c11-8-3-1-4-9(7-8)12-6-2-5-10(12)13/h1,3-4,7H,2,5-6,11H2
InChI Key	ZQGGRBIDRBYUJS-UHFFFAOYSA-N
MDL Number	MFCD00468694
Molecular Formula	C10H12N2O
Molecular Weight	176.2151
SMILES	N1(CCCC1=O)C1C=CC=C(N)C=1
Synonyms	1-(3-aminophenyl)pyrrolidin-2-one, 31992-43-5, 1-(3-Amino-phenyl)-pyrrolidin-2-one, 1-(3-aminophenyl)-2-pyrrolidinone, 2-Pyrrolidinone, 1-(3-aminophenyl)-, ZQGGRBIDRBYUJS-UHFFFAOYSA-N, ZERO/005407, AC1LECGF, ACMC-1AEGQ, AC1Q51GF, Oprea1_818804, SCHEMBL519856, CTK4G8037, ZINC50246, DTXSID60350593, ALBB-005458, ANW-27239, BBL007596, MFCD00468694, SBB010598, SP4143, STK500352, 2-Pyrrolidinone,1-(3-aminophenyl)-, AKOS000199749, MCULE-1027735552, KS-00001W70, AJ-09093, BAS 03320312, CJ-00297, SC-30167, ST070537, AB0062294, DB-029323, ST2414974, TR-013503, BB 0256553, FT-0677641, V5133, EN300-13966, W-7154, 1-(3-Aminophenyl)pyrrolidin-2-one, AldrichCPR, 3Y-0809, I11-964, SR-01000509899, J-018593, SR-01000509899-1, Z96092030, F2148-0021, 1- PYRROLIDIN-2-ONE, C10H12N2O, CID683956,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.219g/mol
Monoisotopic Mass	176.095g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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