3-Pyridinecarboxylic acid, 5-chloro-1,2-dihydro-2-oxo-


Chemical Name: 3-Pyridinecarboxylic acid, 5-chloro-1,2-dihydro-2-oxo-
CAS Number: 38076-80-1
Product Number: AG003MMV(AGN-PC-0JPNJ9)
Synonyms:
MDL No: MFCD00204158
Molecular Formula: C6H4ClNO3
Molecular Weight: 173.5539

Identification/Properties


Properties
MP:
260 °C
BP:
343.8°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
173.552g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
172.988g/mol
Monoisotopic Mass:
172.988g/mol
Topological Polar Surface Area:
66.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
280
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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