AG000TOB

129779-30-2 | 1-Boc-cis-3,5-dimethyl-piperazine

AG000TOB

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CAS Number	129779-30-2
Catalog Number	AG000TOB(AGN-PC-0O0X59)
Chemical Name	1-Boc-cis-3,5-dimethyl-piperazine
IUPAC Name	tert-butyl (3S,5R)-3,5-dimethylpiperazine-1-carboxylate
InChI	InChI=1S/C11H22N2O2/c1-8-6-13(7-9(2)12-8)10(14)15-11(3,4)5/h8-9,12H,6-7H2,1-5H3/t8-,9+
InChI Key	NUZXPHIQZUYMOR-DTORHVGOSA-N
MDL Number	MFCD06795911
Molecular Formula	C11H22N2O2
Molecular Weight	214.3046
SMILES	O=C(N1C[C@@H](C)N[C@@H](C)C1)OC(C)(C)C
Synonyms	129779-30-2, (3R,5S)-rel-tert-Butyl 3,5-dimethylpiperazine-1-carboxylate, cis-1-boc-3,5-dimethylpiperazine, (3S,5R)-TERT-BUTYL 3,5-DIMETHYLPIPERAZINE-1-CARBOXYLATE, 1152111-14-2, (3R,5S)-tert-butyl 3,5-Dimethylpiperazine-1-carboxylate, Tert-butyl (3R,5S)-3,5-dimethylpiperazine-1-carboxylate, 1-BOC-CIS-3,5-DIMETHYL-PIPERAZINE, cis-3,5-dimethylpiperazine-1-carboxylic acid tert-butyl ester, 1-Piperazinecarboxylic acid, 3,5-dimethyl-, 1,1-dimethylethyl ester, cis-, cis-3,5-Dimethyl-piperazine-1-carboxylic acid tert-butyl ester, AK141525, SCHEMBL64563, KS-00000QQN, DTXSID70445383, NUZXPHIQZUYMOR-DTORHVGOSA-N, PS-J-050, EBD218833, MFCD06795911, ZINC12955294, AKOS016015106, AB29282, CS-W019256, DS-7286, FCH2343731, AC-30162, AJ-63180, AM803143, BBV-50426942, AX8212210, AX8239559, ST2419920, FT-0646890, ST24034496, EN300-154309, M-2038, 1-Boc-cis-3,5-dimethyl-piperazine, AldrichCPR, cis-1-tert-butoxycarbonyl-3,5-dimethyl piperazine, (cis) 2,6-Dimethyl-4-tertbutyloxycarbonylpiperizine, N-(tert-butoxycarbonyl)-cis-3,5-dimethylpiperazine, tert-butyl cis-3,5-dimethyl-1-piperazinecarboxylate, tert-butyl cis-3,5-dimethylpiperazine-1-carboxylate, tert-butyl (cis)-3,5-dimethyl-1-piperazinecarboxylate, tert-butyl(cis)-3,5-dimethyl-1-piperazinecarboxylate, tertbutyl (cis)-3,5-dimethyl-1-piperazinecarboxylate, (3 S,5R)-tert-butyl 3,5-dimethylpiperazine-1-carboxylate, (3S*,5R*)-tert-butyl 3,5-dimethylpiperazine-1-carboxylate, 1-(1,1-Dimethylethoxycarbonyl)-cis-3,5-dimethylpiperazine, tert-butyl (3S,5R)-3,5-dimethylpiperazine-1-carboxylate, (3S, 5R)-tert-butoxyl-3,5-diMethyl-1-carbonyl-1,4-diazepine, (3S,5R)-rel-tert-Butyl 3,5-dimethylpiperazine-1-carboxylate, rel-(3S,5R)-tert-Butyl 3,5-dimethylpiperazine-1-carboxylate, (3S,5R)-3,5-dimethyl-piperazine-1-carboxylic acid tert-butyl ester, (cis)-3,5-dimethyl-piperazine-1-carboxylic acid tert-butyl ester, 1,1-dimethylethyl (3R,5S)-3,5-dimethyl-1-piperazinecarboxylate, (3R,5S)-3,5-dimethyl-1-piperazinecarboxylic acid, 1,1-dimethylethyl ester, (3R,5S)-3,5-DIMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, 1-PIPERAZINECARBOXYLIC ACID, 3,5-DIMETHYL-, 1,1-DIMETHYLETHYL ESTER, (3R,5S)-REL-, 1-Boc-3,5-dimethylpiperazine, ACN-051616, 1-BOC-3,5-DIMETHYL-PIPERAZINE, CID10822535, tert-butyl 3,5-dimethylpiperazine-1-carboxylate, 639068-43-2,

Complexity	225
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	9
Hazard statements	H302-H315-H319-H332-H335
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

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