C1=CN(C(=O)C(=C1)C(=O)O)C2=CC=C(C=C2)F
CAS: 868171-67-9
Name: 1-(4-fluorophenyl)-2-oxopyridine-3-carboxylic acid
SMILES: C1=CN(C(=O)C(=C1)C(=O)O)C2=CC=C(C=C2)F

Molecular Processing

Molecular formula
C12H8FNO3
Molecular weight
233.2
Exact mass
233.0488
XLogP
1.67
TPSA
59.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
58.96

Supplementary Information

InChIKey: WPJGHIVGAOVUAT-UHFFFAOYSA-N
Synonyme
868171-67-91-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxylic acid3-Pyridinecarboxylic acid, 1-(4-fluorophenyl)-1,2-dihydro-2-oxo-MFCD193213941-(4-FLUOROPHENYL)-2-OXOPYRIDINE-3-CARBOXYLIC ACID1-(4-Fluorophenyl-1,2-dihydro-2-oxo-3-pyridinecarboxylic acid1-(4-fluoro-phenyl)-2-oxo-1,2-dihydro-pyridine-3-carboxylic acidSCHEMBL362582DTXSID80610606WPJGHIVGAOVUAT-UHFFFAOYSA-NAKOS022186032AS-71746SY126839DB-345293CS-0101567F304009A1-327061-(4-fluorophenyl)-2-oxo-pyridine-3-carboxylic acid1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridin-3-carboxylic acid1-(4-fluorophenyl)-2-oxo-1,2-dihydropyridine-3-carboxylicacid
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