AG00EOX1

60555-57-9 | benzyl 5-oxoprolinate

AG00EOX1

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	60555-57-9
Catalog Number	AG00EOX1(AGN-PC-0OD4F9)
Chemical Name	benzyl 5-oxoprolinate
EC Number	262-291-2
IUPAC Name	benzyl 5-oxopyrrolidine-2-carboxylate
InChI	InChI=1S/C12H13NO3/c14-11-7-6-10(13-11)12(15)16-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,13,14)
InChI Key	NVKOCDGGRHAHOJ-UHFFFAOYSA-N
MDL Number	MFCD03654596
Molecular Formula	C12H13NO3
Molecular Weight	219.2365
SMILES	O=C(C1NC(=O)CC1)OCC1=CC=CC=C1
Synonyms	benzyl 5-oxopyrrolidine-2-carboxylate, 60555-57-9, (S)-Benzyl 5-oxopyrrolidine-2-carboxylate, 94885-52-6, Enamine_003588, Oprea1_130188, MLS000564812, SCHEMBL841868, AC1L344D, AC1Q661I, CHEMBL1313337, CTK5B1688, NVKOCDGGRHAHOJ-UHFFFAOYSA-N, HMS1404D02, HMS2442F21, Proline, 5-oxo-,phenylmethyl ester, MFCD03654596, benzyl 5-oxo-2-pyrrolidinecarboxylate, FCH1672743, IDI1_007231, NCGC00246146-01, SMR000152026, 5-Oxo-2-pyrrolidinecarboxylic acid benzyl ester, EN300-221965, 5-Oxo-pyrrolidine-2-carboxylic acid benzyl ester, SR-01000035720, SR-01000035720-1, Benzyl 5-oxoprolinate, Benzyl PCA, benzyl5-oxoprolinate, UNII-OUS14HJ3HZ, EINECS 262-291-2, AR-1H9492, C12-H13-N-O3, CID108474, (R)-Benzyl 5-oxopyrrolidine-2-carboxylate, 261951-61-5, 62314-22-1,

Complexity	271
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	219.09g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	219.24g/mol
Monoisotopic Mass	219.09g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number