AG000GZW

1158758-59-8 | 1-Pyrrolidinecarboxylic acid, 3-amino-3-methyl-, 1,1-dimethylethyl ester

AG000GZW

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CAS Number	1158758-59-8
Catalog Number	AG000GZW(AGN-PC-0WA7ZA)
Chemical Name	1-Pyrrolidinecarboxylic acid, 3-amino-3-methyl-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 3-amino-3-methylpyrrolidine-1-carboxylate
InChI	InChI=1S/C10H20N2O2/c1-9(2,3)14-8(13)12-6-5-10(4,11)7-12/h5-7,11H2,1-4H3
InChI Key	KYRWEDDXBNZACB-UHFFFAOYSA-N
MDL Number	MFCD12408544
Molecular Formula	C10H20N2O2
Molecular Weight	200.2780
SMILES	O=C(N1CC(C)(N)CC1)OC(C)(C)C
Synonyms	1158758-59-8, tert-butyl 3-amino-3-methylpyrrolidine-1-carboxylate, 3-AMINO-1-BOC-3-METHYLPYRROLIDINE, TERT-BUTYL 3-AMINO-3-METHYL-PYRROLIDINE-1-CARBOXYLATE, 1-BOC-3-AMINO-3-METHYLPYRROLIDINE, SCHEMBL358661, DTXSID90725598, KYRWEDDXBNZACB-UHFFFAOYSA-N, MFCD12408544, AKOS015949547, PB19280, RP07316, KS-000003M7, AS-33668, DA-47714, ST1030161, CS-0048318, FT-0684839, Y7129, C-8917, J-524519, W-204859, 3-AMINO-3-METHYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, 1-PYRROLIDINECARBOXYLIC ACID, 3-AMINO-3-METHYL-, 1,1-DIMETHYLETHYL ESTER, C10H20N2O2, 115875-85-9,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.152g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	200.282g/mol
Monoisotopic Mass	200.152g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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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