4-Pyridinecarboxylic acid, 3-(3-methylphenyl)-


Chemical Name: 4-Pyridinecarboxylic acid, 3-(3-methylphenyl)-
CAS Number: 100004-79-3
Product Number: AG00H942(AGN-PC-00MJXY)
Synonyms:
MDL No:
Molecular Formula: C13H11NO2
Molecular Weight: 213.2319

Identification/Properties


Computed Properties
Molecular Weight:
213.236g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
213.079g/mol
Monoisotopic Mass:
213.079g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
254
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


Request for Quotation


Customer Feedback