AG00CIP9

331767-56-7 | t-Butyl 4-(6-bromopyridin-2-yl)piperazine-1-carboxylate

AG00CIP9

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CAS Number	331767-56-7
Catalog Number	AG00CIP9(AGN-PC-00S8A3)
Chemical Name	t-Butyl 4-(6-bromopyridin-2-yl)piperazine-1-carboxylate
IUPAC Name	tert-butyl 4-(6-bromopyridin-2-yl)piperazine-1-carboxylate
InChI	InChI=1S/C14H20BrN3O2/c1-14(2,3)20-13(19)18-9-7-17(8-10-18)12-6-4-5-11(15)16-12/h4-6H,7-10H2,1-3H3
InChI Key	CQSAPHUUCUUHNS-UHFFFAOYSA-N
MDL Number	MFCD07369773
Molecular Formula	C14H20BrN3O2
Molecular Weight	342.2315
SMILES	O=C(N1CCN(C2=NC(Br)=CC=C2)CC1)OC(C)(C)C
Synonyms	331767-56-7, tert-butyl 4-(6-bromopyridin-2-yl)piperazine-1-carboxylate, 4-Boc-1-(6-bromo-2-pyridyl)piperazine, T-BUTYL 4-(6-BROMOPYRIDIN-2-YL)PIPERAZINE-1-CARBOXYLATE, MFCD07369773, 2-(1-Boc-1-piperazinyl)-6-bromopyridine, ACMC-1CTVY, SCHEMBL441495, CTK4H0101, DTXSID80581600, CQSAPHUUCUUHNS-UHFFFAOYSA-N, ANW-27563, ZINC34951956, AKOS015835977, AB32242, AM86865, RL03205, RTR-013897, AJ-90465, 2-(N-Boc-piperazin-1-yl)-6-bromopyridine, RT-000627, V5233, B-5140, 4-Boc-1-(6-bromo-2-pyridyl)piperazine, 97%, I13-370, 4-BOC-1-(6-BROMO-PYRIDIN-2-YL)PIPERAZINE, J-019066, J-514514, tert.butyl 4-(6-bromo-pyridin-2-yl)-piperazine-1-carboxylate, 4-(6-Bromo-2-pyridyl)piperazine-1-carboxylic acid tert-butyl ester, 4-(6-bromopyridin-2-yl)-piperazine-1-carboxylic acid tert-butyl ester, 4-(6-bromopyridin-2-yl)piperazine-1-carboxylic acid tert-butyl ester, 1-PIPERAZINECARBOXYLIC ACID, 4-(6-BROMO-2-PYRIDINYL)-, 1,1-DIMETHYLETHYL ESTER, tert-Butyl 4-(6 inverted exclamation marka-bromopyrid-2 inverted exclamation marka-yl)piperazine-1-carboxylate, 5,6-BENZOFLAVONE, C14H20BrN3O2, ACN-041694, 6051-87-2,

Complexity	338
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	341.074g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	342.237g/mol
Monoisotopic Mass	341.074g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	45.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301-H319
Packing Group	Ⅲ
Precautionary statements	P301+P310-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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