AG003RIG

171110-72-8 | (2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate, HCl

AG003RIG

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CAS Number	171110-72-8
Catalog Number	AG003RIG(AGN-PC-0Q9UUG)
Chemical Name	(2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate, HCl
IUPAC Name	1-O-tert-butyl 2-O-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate;hydrochloride
InChI	InChI=1S/C11H20N2O4.ClH/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;1H/t7-,8-;/m0./s1
InChI Key	KFYCQKLSGMAVQH-WSZWBAFRSA-N
MDL Number	MFCD03787927
Molecular Formula	C11H21ClN2O4
Molecular Weight	280.7484
SMILES	Cl.C(=O)(OC(C)(C)C)N1[C@H](C(=O)OC)C[C@@H](C1)N
Synonyms	171110-72-8, Methyl (2S,4S)-1-Boc-4-aminopyrrolidine-2-carboxylate hydrochloride, (2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate hydrochloride, MFCD03787927, N-BOC-CIS-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDE, (2S,4S)-1-BOC-4-amino Pyrrolidine-2-carboxylic acid methylester-HCl, 1-tert-butyl 2-methyl cis-4-aminopyrrolidine-1,2-dicarboxylate hydrochloride, 1-tert-butyl 2-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate hydrochloride, N-BOC-CIS-4-AMINO-L-PROLINE METHYL ESTER HYDROCHLORIDE SALT, (2S,4S)-1-BOC-4-amino Pyrrolidine-2-carboxylic acid methylester hydrochloride, C11H21ClN2O4, KFYCQKLSGMAVQH-WSZWBAFRSA-N, AK-47663, 4-aminopyrrolidine-1,2-dicarboxylatehydrochloride, SCHEMBL1412084, CTK8C4938, DTXSID00592157, KS-000006OT, ZX-RL005702, ANW-73561, AKOS015969096, AKOS016015694, ACN-051141, CB-3514, CS-W014011, PB23355, RTR-007518, AN-30790, DS-14434, OR307066, AB0000999, AX8143663, ST2407077, TR-007518, FT-0084091, W3731, 110B728, n-boc-cis-4-amino-l-proline methylester hydrochlorid, N-Boc-(2S,4S)-4-Amino-L-proline methyl ester HCl, Boc-cis-4-amino-L-proline methyl esterhydrochloride salt, (2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate, HCl, Methyl (2S,4S);-1-Boc-4-aminopyrrolidine-2-carboxylate hydrochloride, 1-tert-Butyl 2-methyl (2S,4S)-4-amino-1,2-pyrrolidinedicarboxylate hydrochloride, O1-tert-butyl O2-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate hydrochloride, 1,2-Pyrrolidinedicarboxylic acid, 4-amino-, 1-(1,1-dimethylethyl) 2-methyl ester, hydrochloride (1:1), (2S,4S)-, 1-tert-Butyl 2-methyl (2S,4S)-4-aminopyrrolidine-1,2-dicarboxylate--hydrogen chloride (1/1), A3772, B-2160, (S,S)-1-Boc-4-aminoproline methyl ester hydrochloride, (2R,4R)-1-tert-butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate,

Complexity	311
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	280.119g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	280.749g/mol
Monoisotopic Mass	280.119g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	81.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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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