AG003E0N

5291-77-0 | 1-Benzylpyrrolidin-2-one

AG003E0N

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CAS Number	5291-77-0
Catalog Number	AG003E0N(AGN-PC-0JLRTV)
Chemical Name	1-Benzylpyrrolidin-2-one
EC Number	226-131-5
IUPAC Name	1-benzylpyrrolidin-2-one
InChI	InChI=1S/C11H13NO/c13-11-7-4-8-12(11)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2
InChI Key	LVUQCTGSDJLWCE-UHFFFAOYSA-N
MDL Number	MFCD00003195
Molecular Formula	C11H13NO
Molecular Weight	175.2270
NSC Number	30184
SMILES	O=C1N(CC2=CC=CC=C2)CCC1
Synonyms	1-benzylpyrrolidin-2-one, 5291-77-0, 1-Benzyl-2-pyrrolidinone, N-Benzyl-2-pyrrolidone, 1-Benzyl-2-pyrrolidone, N-Benzyl-2-pyrrolidinone, N-Benzylpyrrolidin-2-one, 2-Pyrrolidinone, 1-(phenylmethyl)-, N-Benzylpyrrolidone, LVUQCTGSDJLWCE-UHFFFAOYSA-N, MFCD00003195, 1-Benzyl-2-pyrrolidinone, 97%, 1-benzylpyrrolidone, NSC30184, EINECS 226-131-5, N-benzylpyrrolidinone, ACMC-1ASTE, AC1L2WTM, AC1Q6LIV, 1-benzyl-2-oxopyrrolidine, N-BENZYL PYRROLIDONE, 1-Benzyl-pyrrolidin-2-one, 1-Benzylazacyclopentan-2-one, 2-Pyrrolidinone, 1-benzyl-, MLS001074862, SCHEMBL180739, 1-benzyl-azacyclopentan-2-one, 1-Phenylmethyl-2-pyrrolidinone, Maleimide-Related Compound 15, BDBM7816, CHEMBL388086, DTXSID70200959, 1-(phenylmethyl)-2-pyrrolidinone, 1-Benzyl-2-pyrrolidinone, 98%, HMS2234P03, HMS3372N20, N-BENZYL-GAMMA-BUTYROLACTAM, ZINC388147, ANW-63069, NSC-30184, SBB026855, STK510265, AKOS005169162, AB00299, AC-7585, AN-8866, FS-2416, MCULE-9141342964, TRA0040453, VZ36502, NCGC00246986-01, AJ-20451, SMR000568394, U527, ZB011317, DB-052205, ST2415164, TR-018736, FT-0635601, ST45135608, M-2707, W-202997, InChI=1/C11H13NO/c13-11-7-4-8-12(11)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H, 1-Benzyl-3-pyrrolidone, C11H13NO, C11-H13-N-O, CID79176, AR-1K6370, 4223-09-0,

Complexity	185
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.1g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	175.231g/mol
Monoisotopic Mass	175.1g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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