AG002F4O

191231-58-0 | 1-Pyrrolidinecarboxylic acid, 2-[(methylamino)methyl]-, 1,1-dimethylethyl ester, (2S)-

AG002F4O

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CAS Number	191231-58-0
Catalog Number	AG002F4O(AGN-PC-0QKBR7)
Chemical Name	1-Pyrrolidinecarboxylic acid, 2-[(methylamino)methyl]-, 1,1-dimethylethyl ester, (2S)-
IUPAC Name	tert-butyl (2S)-2-(methylaminomethyl)pyrrolidine-1-carboxylate
InChI	InChI=1S/C11H22N2O2/c1-11(2,3)15-10(14)13-7-5-6-9(13)8-12-4/h9,12H,5-8H2,1-4H3/t9-/m0/s1
InChI Key	NHOPGDPSLMBDQD-VIFPVBQESA-N
MDL Number	MFCD07786221
Molecular Formula	C11H22N2O2
Molecular Weight	214.3046
SMILES	O=C(N1[C@H](CNC)CCC1)OC(C)(C)C
Synonyms	191231-58-0, (S)-TERT-BUTYL 2-((METHYLAMINO)METHYL)PYRROLIDINE-1-CARBOXYLATE, (S)-1-Boc-2-(Methylaminomethyl)pyrrolidine, (S)-2-Methylaminomethyl-pyrrolidine-1-carboxylic acid tert-butyl ester, tert-butyl (2S)-2-(methylaminomethyl)pyrrolidine-1-carboxylate, tert-Butyl (2S)-2-[(methylamino)methyl]pyrrolidine-1-carboxylate, (S)-1-BOC-2-(METHYLAMINOMETHYL)-PYRROLIDINE, SCHEMBL1598051, CTK4E0614, KS-00000LNG, DTXSID00640526, BBL102989, MFCD07786221, STL556798, ZINC11593852, AKOS017343500, CB-1793, DS-6823, FCH3656227, ACM191231580, AJ-59868, AM100446, AB1006656, AX8048454, DB-065739, FT-0772081, (S)-1-N-Boc-2-(methylaminomethyl)pyrrolidine, A26518, B-1576, (S)-1-Boc-2-(N-methylaminomethyl)-pyrrolidine, (S)-t-Butyl 2-((methylamino)methyl)pyrrolidine-1-carboxylate, tert-butyl (S)-2-((methylamino)methyl)pyrrolidine-1-carboxylate, 1-Pyrrolidinecarboxylic acid, 2-[(methylamino)methyl]-, 1,1-dimethylethyl ester, (2S)-, 1-Pyrrolidinecarboxylicacid, 2-[(methylamino)methyl]-, 1,1-dimethylethyl ester, (2S)-, 1-Pyrrolidinecarboxylicacid,2-[(methylamino)methyl]-,1,1-dimethylethyl ester,(2S)-, (S)-N-Methyl-1-(1-Boc-pyrrolidin-2-yl)methanamine; (S)-tert-Butyl 2-((methylamino)methyl)pyrrolidine-1-carboxylate,

Complexity	223
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	214.168g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	214.309g/mol
Monoisotopic Mass	214.168g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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