AG005UWU

746658-74-2 | 1-(tert-Butoxycarbonyl)-2-methylpiperidine-2-carboxylic acid

AG005UWU

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CAS Number	746658-74-2
Catalog Number	AG005UWU(AGN-PC-059B1B)
Chemical Name	1-(tert-Butoxycarbonyl)-2-methylpiperidine-2-carboxylic acid
IUPAC Name	2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid
InChI	InChI=1S/C12H21NO4/c1-11(2,3)17-10(16)13-8-6-5-7-12(13,4)9(14)15/h5-8H2,1-4H3,(H,14,15)
InChI Key	BDAXXVZMKUJADB-UHFFFAOYSA-N
MDL Number	MFCD09910215
Molecular Formula	C12H21NO4
Molecular Weight	243.2994
SMILES	CC(C)(C)OC(=O)N1CCCCC1(C)C(O)=O
Synonyms	746658-74-2, 1-(tert-Butoxycarbonyl)-2-methylpiperidine-2-carboxylic acid, 1-Boc-2-methylpipecolinic acid, 1-Boc-2-methyl-2-piperidinecarboxylic acid, 1-[(tert-butoxy)carbonyl]-2-methylpiperidine-2-carboxylic acid, 2-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-2-carboxylic acid, SCHEMBL705581, CTK5E0272, DTXSID60655212, BDAXXVZMKUJADB-UHFFFAOYSA-N, 2-Methyl-piperidine-1,2-dicarboxylic acid 1-tert-butyl ester, ALBB-026732, CS-M0416, KS-000005QM, 1606AC, ANW-71392, MFCD09910215, AKOS004910668, CCG-211590, RP28585, SB13884, AK-90276, DS-16829, AB0075379, RT-006210, BB 0262587, B67448, X-1028, J-504344, (+/-)-1-tert-butoxycarbonyl-2-methylpiperidine-2-carboxylic acid, (rac)-2-methyl-piperidine-1,2-dicarboxylic acid 1-tert-butyl ester, 1,2-Piperidinedicarboxylic acid, 2-methyl-, 1-(1,1-dimethylethyl) ester, 1,2-Piperidinedicarboxylicacid, 2-methyl-, 1-(1,1-dimethylethyl) ester, C12H21NO4,

Complexity	321
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.147g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	243.303g/mol
Monoisotopic Mass	243.147g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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