200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1225956-67-1
1225956-67-1 | 2-Pyridinecarboxylic acid, 5-(4-methylphenyl)-
CAS No: 1225956-67-1 Catalog No: AG0017HV MDL No:MFCD16308584
Product Description
Catalog Number:
AG0017HV
Chemical Name:
2-Pyridinecarboxylic acid, 5-(4-methylphenyl)-
CAS Number:
1225956-67-1
Molecular Formula:
C13H11NO2
Molecular Weight:
213.2319
MDL Number:
MFCD16308584
IUPAC Name:
5-(4-methylphenyl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C13H11NO2/c1-9-2-4-10(5-3-9)11-6-7-12(13(15)16)14-8-11/h2-8H,1H3,(H,15,16)
InChI Key:
PYNSPFQIGYWYOJ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1ccc(nc1)C(=O)O
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.236g/mol
Monoisotopic Mass:
213.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.