4-Pyridinecarboxylic acid, 3-chloro-2-fluoro-


Chemical Name: 4-Pyridinecarboxylic acid, 3-chloro-2-fluoro-
CAS Number: 741683-19-2
Product Number: AG005DVE(AGN-PC-0NI00O)
Synonyms:
MDL No:
Molecular Formula: C6H3ClFNO2
Molecular Weight: 175.5449

Identification/Properties


Properties
MP:
154℃ (decomp)(Solv: ethyl acetate (141-78-6); hexane (110-54-3))
BP:
404.1°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
175.543g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
174.984g/mol
Monoisotopic Mass:
174.984g/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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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