2-Chloro-3-nitroisonicotinic acid


Chemical Name: 2-Chloro-3-nitroisonicotinic acid
CAS Number: 353281-15-9
Product Number: AG00CLCY(AGN-PC-0WALJH)
Synonyms:
MDL No:
Molecular Formula: C6H3ClN2O4
Molecular Weight: 202.5520

Identification/Properties


Computed Properties
Molecular Weight:
202.55g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
201.978g/mol
Monoisotopic Mass:
201.978g/mol
Topological Polar Surface Area:
96A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
229
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


Other Analytical Data


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