3-Pyridinecarboxylic acid, 6-chloro-5-cyano-2-methyl-, ethyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 6-chloro-5-cyano-2-methyl-, ethyl ester
CAS Number: 64119-42-2
Product Number: AG00ELWS(AGN-PC-0KL45Z)
Synonyms:
MDL No:
Molecular Formula: C10H9ClN2O2
Molecular Weight: 224.6437

Identification/Properties


Properties
BP:
332.4±42.0°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
224.644g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
224.035g/mol
Monoisotopic Mass:
224.035g/mol
Topological Polar Surface Area:
63A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
286
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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