3-Pyridinecarboxylic acid, 5,6-difluoro-


Chemical Name: 3-Pyridinecarboxylic acid, 5,6-difluoro-
CAS Number: 851386-33-9
Product Number: AG003M9W(AGN-PC-009I8W)
Synonyms:
MDL No:
Molecular Formula: C6H3F2NO2
Molecular Weight: 159.0903

Identification/Properties


Properties
MP:
129-132℃ (decomp)(Solv: chloroform (67-66-3))
BP:
291.323°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
159.092g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
159.013g/mol
Monoisotopic Mass:
159.013g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
165
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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