5-(4-carboxy-3-fluorophenyl)pyridine-3-carboxylic acid


Chemical Name: 5-(4-carboxy-3-fluorophenyl)pyridine-3-carboxylic acid
CAS Number: 1258613-93-2
Product Number: AG000OV8(AGN-PC-09Q3ZW)
Synonyms:
MDL No:
Molecular Formula: C13H8FNO4
Molecular Weight: 261.2053

Identification/Properties


Computed Properties
Molecular Weight:
261.208g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
261.044g/mol
Monoisotopic Mass:
261.044g/mol
Topological Polar Surface Area:
87.5A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
363
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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