AG0013DI

137496-71-0 | 1-Pyrrolidinecarboxylic acid, 2-methyl-, 1,1-dimethylethyl ester, (2S)-

AG0013DI

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CAS Number	137496-71-0
Catalog Number	AG0013DI(AGN-PC-0O1DE9)
Chemical Name	1-Pyrrolidinecarboxylic acid, 2-methyl-, 1,1-dimethylethyl ester, (2S)-
IUPAC Name	tert-butyl (2S)-2-methylpyrrolidine-1-carboxylate
InChI	InChI=1S/C10H19NO2/c1-8-6-5-7-11(8)9(12)13-10(2,3)4/h8H,5-7H2,1-4H3/t8-/m0/s1
InChI Key	PPUYUEPZGGATCN-QMMMGPOBSA-N
MDL Number	MFCD06858469
Molecular Formula	C10H19NO2
Molecular Weight	185.2634
SMILES	O=C(N1[C@@H](C)CCC1)OC(C)(C)C
Synonyms	137496-71-0, (S)-tert-butyl 2-methylpyrrolidine-1-carboxylate, (S)-N-Boc-2-methylpyrrolidine, (S)-1-Boc-2-methylpyrrolidine, (S)-1-BOC-2-METHYL-PYRROLIDINE, tert-butyl (2S)-2-methylpyrrolidine-1-carboxylate, AK-58751, SCHEMBL357042, CTK4C0840, KS-00000LNH, DTXSID10430758, PPUYUEPZGGATCN-QMMMGPOBSA-N, ZINC4203908, 6588AA, ANW-61171, MFCD06858469, AKOS015897787, (S)-N-Boc-2-methylpyrrolidine, 95%, AB30509, FCH4012769, AJ-48654, AN-31861, DS-16257, AB0075452, AX8048455, DB-032252, RT-014023, FT-0695309, 496B710, (2S)-1-(tert-Butyloxycarbonyl)-2-methylpyrrolidine, I12-0493, J-007030, 2-(S)-methyl-pyrrolidine-1-carboxylic tert-butyl Ester, (S)-2-Methylpyrrolidine-1-carboxylic acid-tert-butyl ester, 1-Pyrrolidinecarboxylic acid, 2-methyl-, 1,1-dimethylethyl ester, (2S)-, 1-Pyrrolidinecarboxylic acid, 2-methyl-, 1,1-dimethylethyl ester, (S)-, 1-Pyrrolidinecarboxylicacid, 2-methyl-, 1,1-dimethylethyl ester, (2S)-, C10H19NO2, -1-BOC-2-METHYLPYRROLIDINE, CID9794078, A2961, Tert-butyl 2-methylpyrrolidine-1-carboxylate, (S)-tert-Butyl2-methylpyrrolidine-1-carboxylate, (S)-2-METHYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER,

Complexity	196
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	185.142g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	185.267g/mol
Monoisotopic Mass	185.142g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H227-H301-H315-H318-H335-H410
Packing Group	Ⅲ
Precautionary statements	P261-P273-P280-P301+P310-P305+P351+P338
UN Code	UN 2810

Certificate of Analysis

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