AG000LQ2

1242336-80-6 | 4-Pyridinecarboxylic acid, 5-amino-2-bromo-

AG000LQ2

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CAS Number	1242336-80-6
Catalog Number	AG000LQ2(AGN-PC-03CGBH)
Chemical Name	4-Pyridinecarboxylic acid, 5-amino-2-bromo-
IUPAC Name	5-amino-2-bromopyridine-4-carboxylic acid
InChI	InChI=1S/C6H5BrN2O2/c7-5-1-3(6(10)11)4(8)2-9-5/h1-2H,8H2,(H,10,11)
InChI Key	TZANKVNNHOWWKK-UHFFFAOYSA-N
MDL Number	MFCD17016120
Molecular Formula	C6H5BrN2O2
Molecular Weight	217.0201
SMILES	O=C(O)C1=C(N)C=NC(Br)=C1
Synonyms	5-Amino-2-bromoisonicotinic acid, 1242336-80-6, 5-amino-2-bromopyridine-4-carboxylic acid, SCHEMBL11784380, CTK8C4558, DTXSID90615662, ANW-72345, MFCD17016120, ZINC85224539, AKOS016007520, PB11266, AK-42019, AS-42996, 5-Amino-2-bromo-4-pyridinecarboxylic acid, AJ-127539, TC-161090, CS-0053918, 4-Pyridinecarboxylic acid, 5-amino-2-bromo-, Q-2542, 627A210,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.953g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	217.022g/mol
Monoisotopic Mass	215.953g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	76.2A^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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