Home Carboxys 2-oxo-6-(pyridin-3-yl)-1,2-dihydropyridine-3-carboxylic acid

2-oxo-6-(pyridin-3-yl)-1,2-dihydropyridine-3-carboxylic acid

CAS No.:
56304-43-9
Catalog Number:
AG01EKEA
Molecular Formula:
C11H8N2O3
Molecular Weight:
216.1928
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Product Description
Catalog Number:
AG01EKEA
Chemical Name:
2-oxo-6-(pyridin-3-yl)-1,2-dihydropyridine-3-carboxylic acid
CAS Number:
56304-43-9
Molecular Formula:
C11H8N2O3
Molecular Weight:
216.1928
IUPAC Name:
2-oxo-6-pyridin-3-yl-1H-pyridine-3-carboxylic acid
InChI:
InChI=1S/C11H8N2O3/c14-10-8(11(15)16)3-4-9(13-10)7-2-1-5-12-6-7/h1-6H,(H,13,14)(H,15,16)
InChI Key:
PVZPPPFCSRLPSW-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc([nH]c1=O)c1cccnc1
Properties
Complexity:
385  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.053g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.196g/mol
Monoisotopic Mass:
216.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties