AG0014Y3

1214377-40-8 | 4-Pyridinecarboxylic acid, 5-bromo-2-fluoro-

AG0014Y3

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CAS Number	1214377-40-8
Catalog Number	AG0014Y3(AGN-PC-0WAGUY)
Chemical Name	4-Pyridinecarboxylic acid, 5-bromo-2-fluoro-
IUPAC Name	5-bromo-2-fluoropyridine-4-carboxylic acid
InChI	InChI=1S/C6H3BrFNO2/c7-4-2-9-5(8)1-3(4)6(10)11/h1-2H,(H,10,11)
InChI Key	DIFWPLZQKZLPHK-UHFFFAOYSA-N
MDL Number	MFCD13185803
Molecular Formula	C6H3BrFNO2
Molecular Weight	219.9959
SMILES	O=C(O)C1=C(Br)C=NC(F)=C1
Synonyms	5-Bromo-2-fluoroisonicotinic acid, 1214377-40-8, 5-BROMO-2-FLUORO-4-PYRIDINECARBOXYLIC ACID, MFCD13185803, ZINC98210504, AKOS024090677, FCH1380752, PC305015, SC-48623, AX8294879, ST24044433, A1-07258, ACN-055583,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.933g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	219.997g/mol
Monoisotopic Mass	218.933g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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