AG0089BS

889676-37-3 | 6-Bromonicotinamide

AG0089BS

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CAS Number	889676-37-3
Catalog Number	AG0089BS(AGN-PC-01VRO6)
Chemical Name	6-Bromonicotinamide
IUPAC Name	6-bromopyridine-3-carboxamide
InChI	InChI=1S/C6H5BrN2O/c7-5-2-1-4(3-9-5)6(8)10/h1-3H,(H2,8,10)
InChI Key	SNMZXTXZEQGKBG-UHFFFAOYSA-N
MDL Number	MFCD00266840
Molecular Formula	C6H5BrN2O
Molecular Weight	201.0207
SMILES	C(=O)(N)c1ccc(nc1)Br
Synonyms	6-Bromonicotinamide, 889676-37-3, 6-bromopyridine-3-carboxamide, 3-Pyridinecarboxamide,6-bromo-, 6-Bromo-nicotinamide, ACMC-209qy5, SCHEMBL668418, 6-Bromonicotinamide, AldrichCPR, AMPD00110, CTK5G2052, DTXSID90593592, SNMZXTXZEQGKBG-UHFFFAOYSA-N, KS-00000OC9, ANW-39195, EBD213292, MFCD00266840, ZINC12471612, AKOS009456291, AM85949, DS-2361, MB01098, PS-4878, RP04294, RTR-027983, AJ-62321, AK-41744, CJ-14083, SC-14910, ST2406436, TR-027983, 4CH-016934, Y5642, B-5567, I02-2223, J-518461, C6H5BrN2O, 6-BROMONICOTINAMIDE98,

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.959g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	201.023g/mol
Monoisotopic Mass	199.959g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	56A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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