Home Carboxys 6-hydroxy-4-(4-methoxyphenyl)pyridine-2-carboxylic acid

6-hydroxy-4-(4-methoxyphenyl)pyridine-2-carboxylic acid

CAS No.:
1503800-85-8
Catalog Number:
AG01DVFE
Molecular Formula:
C13H11NO4
Molecular Weight:
245.2307
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Product Description
Catalog Number:
AG01DVFE
Chemical Name:
6-hydroxy-4-(4-methoxyphenyl)pyridine-2-carboxylic acid
CAS Number:
1503800-85-8
Molecular Formula:
C13H11NO4
Molecular Weight:
245.2307
MDL Number:
MFCD26631485
IUPAC Name:
4-(4-methoxyphenyl)-6-oxo-1H-pyridine-2-carboxylic acid
InChI:
InChI=1S/C13H11NO4/c1-18-10-4-2-8(3-5-10)9-6-11(13(16)17)14-12(15)7-9/h2-7H,1H3,(H,14,15)(H,16,17)
InChI Key:
OCOXKVNXPHGWAE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cc(O)nc(c1)C(=O)O
Properties
Complexity:
417  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.069g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
245.234g/mol
Monoisotopic Mass:
245.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties