3-Pyridinecarboxylic acid, 5-(4-fluorophenyl)-


Chemical Name: 3-Pyridinecarboxylic acid, 5-(4-fluorophenyl)-
CAS Number: 364064-17-5
Product Number: AG00BXS8(AGN-PC-007X3H)
Synonyms:
MDL No: MFCD06410260
Molecular Formula: C12H8FNO2
Molecular Weight: 217.1958

Identification/Properties


Properties
BP:
415.7°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
217.199g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
217.054g/mol
Monoisotopic Mass:
217.054g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
251
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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