4-Cinnolinecarboxylic acid


Chemical Name: 4-Cinnolinecarboxylic acid
CAS Number: 21905-86-2
Product Number: AG00C3VO(AGN-PC-0JLXUO)
Synonyms:
MDL No:
Molecular Formula: C9H6N2O2
Molecular Weight: 174.1561

Identification/Properties


Properties
MP:
175 °C (dec.);(lit.);
BP:
423.7°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
174.159g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
174.043g/mol
Monoisotopic Mass:
174.043g/mol
Topological Polar Surface Area:
63.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
208
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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