AG00BYGS

313706-15-9 | (S)-1-BOC-PYRROLIDINE-3-CARBOXYLIC ACID METHYL ESTER

AG00BYGS

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CAS Number	313706-15-9
Catalog Number	AG00BYGS(AGN-PC-0R6QMS)
Chemical Name	(S)-1-BOC-PYRROLIDINE-3-CARBOXYLIC ACID METHYL ESTER
IUPAC Name	1-O-tert-butyl 3-O-methyl (3S)-pyrrolidine-1,3-dicarboxylate
InChI	InChI=1S/C11H19NO4/c1-11(2,3)16-10(14)12-6-5-8(7-12)9(13)15-4/h8H,5-7H2,1-4H3/t8-/m0/s1
InChI Key	LIWFYAVKYUQMRE-QMMMGPOBSA-N
MDL Number	MFCD09838822
Molecular Formula	C11H19NO4
Molecular Weight	229.2729
SMILES	C(=O)(OC(C)(C)C)N1C[C@H](CC1)C(=O)OC
Synonyms	313706-15-9, (S)-1-Boc-pyrrolidine-3-carboxylic acid methyl ester, (S)-1-tert-butyl 3-methyl pyrrolidine-1,3-dicarboxylate, 1-tert-butyl 3-methyl (3S)-pyrrolidine-1,3-dicarboxylate, Methyl (S)-1-Boc-pyrrolidine-3-carboxylate, (S)-1-Boc-pyrrolidine-1,3-dicarboxylate, AK-39020, PubChem18388, AC1LTTD0, 1-O-tert-butyl 3-O-methyl (3S)-pyrrolidine-1,3-dicarboxylate, SCHEMBL1973022, Jsp005856, DTXSID60363865, LIWFYAVKYUQMRE-QMMMGPOBSA-N, CS-B0425, ZINC1436157, 2960AH, MFCD09838822, SC5089, AKOS022177561, AC-2240, CB-2526, FCH1627042, PB16191, AJ-25983, AN-14156, CJ-05014, DS-13112, SC-23727, AB0000244, AB1005743, ST2401664, FT-0601707, A-5784, A26488, 706B159, (S)-1-Boc-pyrrolidine-3-carboxylic acid methyl est, I14-3828, 1-N-BOC-PYRROLIDINE-3-(S)-METHYL CARBOXYLATE, 1-(tert-butyl) 3-methyl (S)-pyrrolidine-1,3-dicarboxylate, O1-tert-butyl O3-methyl (3S)-pyrrolidine-1,3-dicarboxylate, (S)-Pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester 3-methyl ester, METHYL (S)-1-(TERT-BUTYLOXYCARBONYL)PYRROLIDINE-3-CARBOXYLATE, (S)-1-Boc-pyrrolidine-1,3-dicarboxylate; (S)-1-1-Boc-pyrrolidine-3-carboxylic acid methyl ester; (S)-1-tert-Butoxycarbonyl-pyrrolidine-3-carboxylic acid methyl ester; (R)-1-tert-butyl 3-methyl pyrrolidine-1,3-dicarboxylate, C11H19NO4, (S)-1-Boc- pyrrolidine-1,3-dicarboxylate, S-1-BOC-Pyrrolidine-3-carboxylic acid methyl ester, 1-tert-butyl 3-methyl pyrrolidine-1,3-dicarboxylate, 1-tert-butyl 3-methyl (3R)-pyrrolidine-1,3-dicarboxylate, Pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester 3-methyl ester, 122684-33-7, 441717-40-4,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	229.131g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	229.276g/mol
Monoisotopic Mass	229.131g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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