AG0037KZ

571189-16-7 | tert-Butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate

AG0037KZ

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CAS Number	571189-16-7
Catalog Number	AG0037KZ(AGN-PC-0054Y1)
Chemical Name	tert-Butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate
EC Number	801-163-8
IUPAC Name	tert-butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate
InChI	InChI=1S/C14H20N4O4/c1-14(2,3)22-13(19)17-8-6-16(7-9-17)11-4-5-12(15-10-11)18(20)21/h4-5,10H,6-9H2,1-3H3
InChI Key	SUWKOEMQNOBJEQ-UHFFFAOYSA-N
MDL Number	MFCD11849291
Molecular Formula	C14H20N4O4
Molecular Weight	308.3330
SMILES	[N+](=O)([O-])C1=CC=C(C=N1)N1CCN(CC1)C(=O)OC(C)(C)C
Synonyms	571189-16-7, Tert-butyl 4-(6-nitropyridin-3-yl)piperazine-1-carboxylate, 1-Boc-4-(6-nitro-3-pyridyl)piperazine, 1-BOC-4-(6-NITROPYRIDIN-3-YL)PIPERAZINE, MFCD11849291, 4-(6-Nitro-pyridin-3-yl)-piperazine-1-carboxylic acid tert-butyl ester, tert-Butyl 4-(6-nitro-3-pyridyl)piperazine-1-carboxylate, 1-Piperazinecarboxylic acid, 4-(6-nitro-3-pyridinyl)-, 1,1-dimethylethyl ester, SCHEMBL1392727, SCHEMBL17525877, CTK8C2406, DTXSID00459953, SUWKOEMQNOBJEQ-UHFFFAOYSA-N, BCP11900, CS-B0331, KS-00000QK4, ANW-68347, ZINC20397437, AKOS009103755, CM14180, MCULE-1853804712, AJ-77378, AK-79765, DS-17740, SC-94410, SY056804, TC-157092, 1-boc-4-(6-nitro-pyridin-3-yl)-piperazine, FT-0697064, ST24049979, MFCD11849291 (97%), 1-Piperazinecarboxylic acid, 4-(6-nitro-3-pyridiny, tert-butyl 4-(6-nitropyridin-3-yl)piperazine-carboxylate, tert.-Butyl 4-(6-nitro-3-pyridinyl)-1-piperazinecarboxylate, 4-(6-nitropyridin-3-yl)piperazine-1-carboxylic acid tert-butyl ester, 1-Piperazinecarboxylic acid,4-(6-nitro-3-pyridinyl)-,1,1-dimethylethyl ester, 4-(6-nitro-3-pyridinyl)-1-piperazinecarboxylic acid, 1,1-dimethylethyl ester, ACN-028670, CID11243758, EC 801-163-8,

Complexity	410
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	308.148g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	308.338g/mol
Monoisotopic Mass	308.148g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	91.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

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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