AG00DEO6

51535-00-3 | Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate

AG00DEO6

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CAS Number	51535-00-3
Catalog Number	AG00DEO6(AGN-PC-0JM3B5)
Chemical Name	Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate
EC Number	257-257-9
IUPAC Name	methyl 1-benzyl-5-oxopyrrolidine-3-carboxylate
InChI	InChI=1S/C13H15NO3/c1-17-13(16)11-7-12(15)14(9-11)8-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3
InChI Key	WTRWSSDZHQOPJI-UHFFFAOYSA-N
MDL Number	MFCD00003196
Molecular Formula	C13H15NO3
Molecular Weight	233.2631
NSC Number	176916
SMILES	O=C(C(C1)CN(CC2=CC=CC=C2)C1=O)OC
Synonyms	Methyl 1-benzyl-5-oxopyrrolidine-3-carboxylate, 51535-00-3, Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate, 51523-00-3, 1-Benzyl-5-oxo-pyrrolidine-3-carboxylic acid methyl ester, Methyl 1-benzyl-5-oxo-pyrrolidine-3-carboxylate, Methyl1-benzyl-5-oxo-3-pyrrolidinecarboxylate, WTRWSSDZHQOPJI-UHFFFAOYSA-N, 3-Pyrrolidinecarboxylic acid, 5-oxo-1-(phenylmethyl)-, methyl ester, methyl 1-benzyl-5-oxo-3-pyrrolidine-carboxylate, methyl 5-oxo-1-benzylpyrrolidine-3-carboxylate, EINECS 257-257-9, NSC176916, PubChem17184, AC1Q6LIP, methyl (3S)-1-benzyl-5-oxopyrrolidine-3-carboxylate, methyl-1-benzyl-5-oxopyrrolidin-3-carboxylat, Bionet2_000906, AC1L40ID, KSC594I0L, MLS000712553, SCHEMBL2584810, 1-Benzyl-5-oxo-3-pyrrolidinecarboxylic acid methyl ester, CHEMBL1606750, CTK4J4405, HMS1366J04, HMS2695B14, methylbenzyloxopyrrolidinecarboxylate, ACT09802, KS-000004GB, KS-00001YB2, ANW-45852, BBL022432, HTS028292, MFCD00003196, SBB054025, STK400199, AKOS000520587, AS06605, MCULE-7588727283, NSC-176916, RP13404, NCGC00245149-01, BAS 00531489, BP-12477, BR-49845, SC-50150, SC-53054, SMR000282320, SY020152, 1-benzyl-4-methoxycarbonyl-2-oxopyrrolidine, AB0001803, DB-031066, TC-063281, TX-017694, 4CH-014221, CS-0049252, EU-0071542, FT-0640003, FT-0698510, ST24030851, ST50233537, W6638, W6642, methyl 1-benzyl-2-oxo-4-pyrrolidylcarboxylate, MFCD00003196 (95%), 6H-020, C-6182, methyl 1-benzyl-5-oxo-3-pyrrolidine carboxylate, Methyl N-benzyl-5-oxo-pyrrolidine-3-carboxylate, SR-01000432887, J-521748, SR-01000432887-1, (+/-) Methyl 1-benzyl-2-oxo-4-pyrrolidylcarboxylate, I14-11455, Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate, 97%, Methyl 1-benzyl-5-oxo-3-pyrrolidine-carboxylate, 98%, methyl 5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylate, methyl-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylate, 5-Oxo-1-(phenylmethyl)-3-pyrrolidinecarboxylic acid methyl ester, C13H15NO3, CID98909, AR-1J6614, C13-H15-N-O3, (R)-Methyl 1-benzyl-5-oxopyrrolidine-3-carboxylate, ACN-030150, A7598, Methyl1-Benzyl-5-oxopyrrolidine-3-carboxylate, (S)-Methyl 1-benzyl-5-oxopyrrolidine-3-carboxylate, METHYL N-BENZYLPYRROLIDINE-3-CARBOXYLATE, 428518-36-9, methyl 1-(phenylmethyl)pyrrolidine-3-carboxylate, METHYL 1-BENZYLLPYRROLIDINE-3-CARBOXYLATE, methyl (3R)-1-benzyl-5-oxopyrrolidine-3-carboxylate, 1-(phenylmethyl)-3-pyrrolidinecarboxylic acid methyl ester, 428518-44-9, Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate, 97% - 25G 25g, 3-PYRROLIDINECARBOXYLIC ACID, 1-(PHENYLMETHYL)-, METHYL ESTER, 52677-27-7,

Complexity	297
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.105g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	233.267g/mol
Monoisotopic Mass	233.105g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

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