AG00I9LM

53788-49-1 | 1-Piperazinecarboxylic acid, 4-methyl-, 1,1-dimethylethyl ester

AG00I9LM

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CAS Number	53788-49-1
Catalog Number	AG00I9LM(AGN-PC-008DG0)
Chemical Name	1-Piperazinecarboxylic acid, 4-methyl-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl 4-methylpiperazine-1-carboxylate
InChI	InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-5-11(4)6-8-12/h5-8H2,1-4H3
InChI Key	CJDYFMIDIQXELO-UHFFFAOYSA-N
MDL Number	MFCD03840525
Molecular Formula	C10H20N2O2
Molecular Weight	200.2780
SMILES	O=C(N1CCN(C)CC1)OC(C)(C)C
Synonyms	53788-49-1, 1-Boc-4-methylpiperazine, Tert-butyl 4-methylpiperazine-1-carboxylate, N-Boc-N-methylpiperazine, 1-Piperazinecarboxylic acid, 4-methyl-, 1,1-dimethylethyl ester, 1-N-Boc-4-methylpiperazine, 1-Boc-4-methyl-piperazine, SCHEMBL82012, CTK8G1691, DTXSID90464713, CJDYFMIDIQXELO-UHFFFAOYSA-N, AB1220, MFCD03840525, ZINC22052832, AKOS008846470, CB-1938, DS-6997, KS-00000K58, 1-methyl-4-tert-butoxycarbonylpiperazine, AJ-80789, AK140243, AN-40739, 1-(tert-Butoxycarbonyl)-4-methylpiperazine, 1-Methyl-4-(tert-butoxycarbonyl)piperazine, DB-071740, CS-0042580, FT-0663532, A829771, 4-methyl-1-piperazinecarboxylic acid tert-butyl ester, 4-methyl-piperazine-1-carboxylic acid tert-butyl ester, 4-Methylpiperazine-1-carboxylic Acid tert-Butyl Ester, CID11401394, 1-Boc-4-methyl-piperazine, 98% - 25G 25g, 4-Methyl-1-piperazinecarboxylic Acid 1,1-Dimethylethyl Ester,

Complexity	203
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	0
Isotope Atom Count	0
Molecular Weight	200.282g/mol
Monoisotopic Mass	200.152g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	32.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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