AG003CLD

59760-01-9 | 1,​5-​Imidazolidinedicarbo​xylic acid, 2-​oxo-​, 1-​(phenylmethyl) ester, (5S)​-

AG003CLD

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CAS Number	59760-01-9
Catalog Number	AG003CLD(AGN-PC-0OCZAR)
Chemical Name	1,​5-​Imidazolidinedicarbo​xylic acid, 2-​oxo-​, 1-​(phenylmethyl) ester, (5S)​-
IUPAC Name	(4S)-2-oxo-3-phenylmethoxycarbonylimidazolidine-4-carboxylic acid
InChI	InChI=1S/C12H12N2O5/c15-10(16)9-6-13-11(17)14(9)12(18)19-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,17)(H,15,16)/t9-/m0/s1
InChI Key	AYSUEIZKNBGWGN-VIFPVBQESA-N
MDL Number	MFCD00192373
Molecular Formula	C12H12N2O5
Molecular Weight	264.2341
SMILES	C(=O)(OCc1ccccc1)N1[C@H](C(=O)O)CNC1=O
Synonyms	59760-01-9, (S)-3-((Benzyloxy)carbonyl)-2-oxoimidazolidine-4-carboxylic acid, (S)-(-)-2-Oxo-1,5-imidazolidinedicarboxylic acid 1-benzyl ester, (4S)-3-[(benzyloxy)carbonyl]-2-oxoimidazolidine-4-carboxylic acid, (S)-3-CBZ-2-Oxo-imidazolidine-4-carboxylic acid, (4S)-3-benzyloxycarbonyl-2-oxo-imidazolidine-4-carboxylic acid, (S)-3-(benzyloxycarbonyl)-2-oxoimidazolidine-4-carboxylic acid, (4S)-3-[(Benzyl-Oxy)Carbonyl]-2-Oxoimidazolidine-4-Carboxylic Acid, (S)-2-OXO-IMIDAZOLIDINE-1,5-DICARBOXYLIC ACID 1-BENZYL ESTER, 2-Oxo-imidazolidine-1,5-dicarboxyli, 1,5-Imidazolidinedicarboxylic acid, 2-oxo-, 1-(phenylmethyl) ester, (5S)-, AC1LELJR, AC1Q71BO, (S)-(?)-1-Z-2-Oxo-5-imidazolidinecarboxylicacid, SCHEMBL464281, CTK1G7759, ZINC56865, DTXSID70350827, AYSUEIZKNBGWGN-VIFPVBQESA-N, ALBB-015026, EBD12470, KS-000018YS, 8900AB, ANW-73467, MFCD00192373, AKOS005174975, AN-4417, FCH3675502, AJ-09460, SC-66274, AB0075733, AX8048075, DB-072695, TC-162212, FT-0684252, R2544, I04-4161, (S)-(-)-1-Z-2-Oxo-5-imidazolidinecarboxylic acid, 98%, 2-Oxoimidazolidine-1,5beta-dicarboxylic acid 1-benzyl ester, 3-benzyloxycarbonyl-2-oxoimidazolidine-4(s)-carboxylic acid, (S)-(-)-2-OXO-1,5-IMIDAZOLIDINEDICARBOXYLIC ACID 1, (4S)-2-oxo-3-phenylmethoxycarbonylimidazolidine-4-carboxylic acid, (4S)-2-oxo-3-{[(phenylmethyl)oxy]carbonyl}-4-imidazolidinecarboxylic acid, Maybridge4_002652, C12H12N2O5, CID688196, A8385, (R)-3-Cbz-2-Oxo-imidazolidine-4-carboxylic acid, (S)-3-((Benzyloxy)carbonyl)-2-oxoimidazolidine-4-carboxylicacid, 634614-25-8,

Complexity	378
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	264.075g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	264.237g/mol
Monoisotopic Mass	264.075g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	95.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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