AG0039R1

1207174-85-3 | 7-bromo-3H-imidazo[4,5-b]pyridine

AG0039R1

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CAS Number	1207174-85-3
Catalog Number	AG0039R1(AGN-PC-0WAC6W)
Chemical Name	7-bromo-3H-imidazo[4,5-b]pyridine
IUPAC Name	7-bromo-1H-imidazo[4,5-b]pyridine
InChI	InChI=1S/C6H4BrN3/c7-4-1-2-8-6-5(4)9-3-10-6/h1-3H,(H,8,9,10)
InChI Key	DEFSPWZHYXXHLB-UHFFFAOYSA-N
MDL Number	MFCD11846335
Molecular Formula	C6H4BrN3
Molecular Weight	198.0201
SMILES	BrC1=C2C(=NC=C1)NC=N2
Synonyms	7-Bromo-3H-imidazo[4,5-b]pyridine, 1207174-85-3, 7-BROMO-1H-IMIDAZO[4,5-B]PYRIDINE, AK-50437, MFCD11846335, 4-Bromo-7-azabenzimidazole, SCHEMBL1165562, CTK5I8809, DTXSID00698421, KS-000003JZ, ZX-AT013466, 3605AA, ANW-72183, FCH923243, ZINC45028268, AKOS006342850, AKOS024071583, OR70030, PB16431, RP25483, DS-15430, AB0047318, AJ-110269, AX8163097, DB-061777, ST1161113, TR-072543, CS-0050085, FT-0732749, C-8326, J-519129, C6H4BrN3,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.959g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	198.023g/mol
Monoisotopic Mass	196.959g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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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