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


Chemical Name: 4-Pyridinecarboxylic acid, 2-chloro-3-fluoro-, methyl ester
CAS Number: 628691-95-2
Product Number: AG00373S(AGN-PC-04RZEB)
Synonyms:
MDL No:
Molecular Formula: C7H5ClFNO2
Molecular Weight: 189.5715

Identification/Properties


Properties
BP:
257.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
189.57g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
188.999g/mol
Monoisotopic Mass:
188.999g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
179
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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