3-Pyridinecarboxylic acid, 4,6-dichloro-5-nitro-, ethyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 4,6-dichloro-5-nitro-, ethyl ester
CAS Number: 154012-15-4
Product Number: AG00AD44(AGN-PC-03FJP3)
Synonyms:
MDL No:
Molecular Formula: C8H6Cl2N2O4
Molecular Weight: 265.0502

Identification/Properties


Computed Properties
Molecular Weight:
265.046g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
263.97g/mol
Monoisotopic Mass:
263.97g/mol
Topological Polar Surface Area:
85A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
284
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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