AG003550

254881-77-1 | Methyl (2R,4S)-4-Amino-1-Boc-2-pyrrolidinecarboxylate

AG003550

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CAS Number	254881-77-1
Catalog Number	AG003550(AGN-PC-0R1940)
Chemical Name	Methyl (2R,4S)-4-Amino-1-Boc-2-pyrrolidinecarboxylate
IUPAC Name	1-O-tert-butyl 2-O-methyl (2R,4S)-4-aminopyrrolidine-1,2-dicarboxylate
InChI	InChI=1S/C11H20N2O4/c1-11(2,3)17-10(15)13-6-7(12)5-8(13)9(14)16-4/h7-8H,5-6,12H2,1-4H3/t7-,8+/m0/s1
InChI Key	IOLQYMRFIIVPMQ-JGVFFNPUSA-N
MDL Number	MFCD08704545
Molecular Formula	C11H20N2O4
Molecular Weight	244.2875
SMILES	N[C@H]1C[C@@H](N(C1)C(=O)OC(C)(C)C)C(=O)OC
Synonyms	254881-77-1, (2R,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate, 1-tert-Butyl 2-methyl (2R,4S)-4-aminopyrrolidine-1,2-dicarboxylate, Methyl (2R,4S)-4-aminopyrrolidine-2-carboxylate, N1-BOC protected, Methyl (2R,4S)-4-Amino-1-Boc-2-pyrrolidinecarboxylate, (2R,4S)-4-Amino-1,2-pyrrolidinedicarboxylic acid 1-(1,1-dimethylethyl) 2-methyl ester, 396729-84-3, IOLQYMRFIIVPMQ-JGVFFNPUSA-N, AK-38996, AC1LU384, SCHEMBL1267008, 1-O-tert-butyl 2-O-methyl (2R,4S)-4-aminopyrrolidine-1,2-dicarboxylate, CTK3J8353, KS-000006CD, ZINC4343364, ZX-AT003081, ANW-61504, CB-136, MFCD08704545, AKOS005258639, AKOS015912027, FCH2717565, OR30679, RP05972, RTR-011636, SB22157, AJ-50687, AN-29314, Boc-trans-4-amino-L-proline methyl ester, DS-13099, AB0077586, AB1006690, AX8044642, TR-011636, A5137, FT-0084112, FT-0679278, B-1630, EN300-189908, N-Boc-(2R,4S)-4-Amino-D-proline methyl ester, 881B771, W-206956, I14-35677, trans-4-amino-n-tert-butoxycarbonyl-d-proline methyl ester, 1-tert-butyl2-methyltrans-4-aminopyrrolidine-1,2-dicarboxylate, (2R,4S)-4-AMINO-1-BOC-PYRROLIDINE-2-CARBOXYLIC ACID METHYL ESTER, 1-(tert-butyl) 2-methyl (2R,4S)-4-aminopyrrolidine-1,2-dicarboxylate, 1-tert-Butyl 2-methyl (2R,4S)-4-amino-1,2-pyrrolidinedicarboxylate, Methyl (2R,4S)-1-(tert-butoxycarbonyl)-4-aMinopyrrolidine-2-carboxylate, O1-tert-butyl O2-methyl (2R,4S)-4-aminopyrrolidine-1,2-dicarboxylate, (2R,4S)-4-aminopyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester, 1,2-Pyrrolidinedicarboxylic acid, 4-amino-, 1-(1,1-dimethylethyl) 2-methyl ester, (2R,4S)-, ZERO/005795, ACN-031279, CID1519499, 1-tert-butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate, 1-tert-butyl 2-methyl trans-4-aminopyrrolidine-1,2-dicarboxylate, 121148-00-3, 1,2-Pyrrolidinedicarboxylicacid,4-amino-,1-(1,1-dimethylethyl)2-methylester,(2R,4S)-,

Complexity	311
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	244.142g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	244.291g/mol
Monoisotopic Mass	244.142g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	81.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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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