AG000L7N

1238951-37-5 | 1-Piperazinecarboxylic acid, 2,5-dimethyl-, 1,1-dimethylethyl ester, (2S,5S)-

AG000L7N

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CAS Number	1238951-37-5
Catalog Number	AG000L7N(AGN-PC-0WA1Y2)
Chemical Name	1-Piperazinecarboxylic acid, 2,5-dimethyl-, 1,1-dimethylethyl ester, (2S,5S)-
IUPAC Name	tert-butyl (2S,5S)-2,5-dimethylpiperazine-1-carboxylate
InChI	InChI=1S/C11H22N2O2/c1-8-7-13(9(2)6-12-8)10(14)15-11(3,4)5/h8-9,12H,6-7H2,1-5H3/t8-,9-/m0/s1
InChI Key	PGZCVLUQTJRRAA-IUCAKERBSA-N
MDL Number	MFCD08686668
Molecular Formula	C11H22N2O2
Molecular Weight	214.3046
SMILES	C[C@H]1CN([C@@H](C)CN1)C(=O)OC(C)(C)C
Synonyms	1238951-37-5, (2S,5S)-tert-Butyl 2,5-dimethylpiperazine-1-carboxylate, (2S,5S)-1-Boc-2,5-dimethylpiperazine, (2S,5S)-2,5-DIMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, 1-PIPERAZINECARBOXYLIC ACID, 2,5-DIMETHYL-, 1,1-DIMETHYLETHYL ESTER, (2S,5S)-, (2S,5S)-1-N-BOC-2,5-DIMETHYLPIPERAZINE, TERT-BUTYL (2S,5S)-2,5-DIMETHYLPIPERAZINE-1-CARBOXYLATE, AK102241, SCHEMBL8095546, CTK4B3666, DTXSID50647949, S-RS-14, PGZCVLUQTJRRAA-IUCAKERBSA-N, 4532AA, ANW-62310, MFCD08686668, ZINC21986744, AKOS015840175, AB47965, CB-1484, CS-W021077, DS-3794, FCH3982215, RP26832, KS-00000Q89, AJ-79471, SC-67959, (2S,5S)-1-Boc-2,5-dimethyl-piperazine, AB0050244, AX8233780, DB-062196, ST2402277, TC-065403, TC-151055, FT-0084007, FT-0653820, FT-0771583, A-5780, cis-1-(tert-butoxycarbonyl)-2,5-dimethylpiperazine, J-501059, (2S,5S)-1-N-Boc-2,5-dimethylpiperazine, AldrichCPR, (2S,5S)-2,5-DIMETHYL-PIPERAZINE-1-CARBOXYLIC ACID, C11H22N2O2, 1-N-Boc-2R,5R-dimethyl-Piperazine, ACN-030992, (2S,5S)-tert-Butyl2,5-dimethylpiperazine-1-carboxylate, (2R,5S)-tert-Butyl 2,5-dimethylpiperazine-1-carboxylate, 194032-43-4, 309915-46-6,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
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	2
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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