3-Pyridinecarboxylic acid, 2-chloro-5-iodo-, methyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 2-chloro-5-iodo-, methyl ester
CAS Number: 78686-83-6
Product Number: AG0036GL(AGN-PC-0KKQBI)
Synonyms:
MDL No:
Molecular Formula: C7H5ClINO2
Molecular Weight: 297.4776

Identification/Properties


Properties
MP:
70-73°
BP:
329.0±42.0°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
297.476g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
296.905g/mol
Monoisotopic Mass:
296.905g/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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