AG000QFS

1201643-59-5 | Piperazine, 1-(4-bromo-2-pyridinyl)-

AG000QFS

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CAS Number	1201643-59-5
Catalog Number	AG000QFS(AGN-PC-0WAA35)
Chemical Name	Piperazine, 1-(4-bromo-2-pyridinyl)-
IUPAC Name	1-(4-bromopyridin-2-yl)piperazine
InChI	InChI=1S/C9H12BrN3/c10-8-1-2-12-9(7-8)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2
InChI Key	CRQIQJZMQXBIHG-UHFFFAOYSA-N
MDL Number	MFCD16618975
Molecular Formula	C9H12BrN3
Molecular Weight	242.1157
SMILES	BrC1=CC(N2CCNCC2)=NC=C1
Synonyms	1-(4-Bromopyridin-2-yl)piperazine, 1201643-59-5, 4-Bromo-2-piperazinopyridine, 1-(4-Bromo-2-pyridyl)piperazine, ACMC-209a6h, SCHEMBL1558641, CTK4B1711, DTXSID30682398, CRQIQJZMQXBIHG-UHFFFAOYSA-N, ANW-17463, MFCD16618975, ZINC65337462, AKOS015835346, FCH1345907, Piperazine, 1-(4-bromo-2-pyridinyl)-, SY223922, AJ-115167, AX8229794, TR-034442, ST24021102, Z8194, MFCD16618975 (97%), A-5398, I02-3134, C9H12BrN3,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.021g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	242.12g/mol
Monoisotopic Mass	241.021g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	28.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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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