3-Pyridinecarboxylic acid, 5-bromo-2-fluoro-


Chemical Name: 3-Pyridinecarboxylic acid, 5-bromo-2-fluoro-
CAS Number: 29241-66-5
Product Number: AG002XUC(AGN-PC-04Q047)
Synonyms:
MDL No: MFCD06797939
Molecular Formula: C6H3BrFNO2
Molecular Weight: 219.9959

Identification/Properties


Properties
MP:
141 - 142 °C
BP:
327.4°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
219.997g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
218.933g/mol
Monoisotopic Mass:
218.933g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
167
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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