2-Pyridinecarboxylic acid, 4-chloro-, 1,1-dimethylethyl ester


Chemical Name: 2-Pyridinecarboxylic acid, 4-chloro-, 1,1-dimethylethyl ester
CAS Number: 220000-86-2
Product Number: AG006XTU(AGN-PC-00GJJT)
Synonyms:
MDL No:
Molecular Formula: C10H12ClNO2
Molecular Weight: 213.6608

Identification/Properties


Computed Properties
Molecular Weight:
213.661g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
213.056g/mol
Monoisotopic Mass:
213.056g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
213
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

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NMR Spectrum


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