3-Pyridinecarboxylic acid, 2,6-dichloro-5-fluoro-, methyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 2,6-dichloro-5-fluoro-, methyl ester
CAS Number: 189281-66-1
Product Number: AG002I7B(AGN-PC-0KKWSW)
Synonyms:
MDL No:
Molecular Formula: C7H4Cl2FNO2
Molecular Weight: 224.0166

Identification/Properties


Computed Properties
Molecular Weight:
224.012g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
222.96g/mol
Monoisotopic Mass:
222.96g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
205
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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