Basic information
- Standard SMILES
O=C(O)c1cc(Cl)cn(Cc2ccccc2)c1=O- InChIKey
HPIOWOMSNUANFN-UHFFFAOYSA-N- Molecular formula
- C13H10ClNO3
- Average molar mass
- 263.67 g/mol
- Monoisotopic mass
- 263.0349209
Names & identifiers
- Preferred name
- 1-Benzyl-5-chloro-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid
- IUPAC
- 1-benzyl-5-chloro-2-oxopyridine-3-carboxylic acid
Names & synonyms
101384-62-71-BENZYL-5-CHLORO-2-OXO-1,2-DIHYDRO-3-PYRIDINECARBOXYLIC ACID1-Benzyl-5-chloro-2-oxo-1,2-dihydropyridine-3-carboxylic acid1-benzyl-5-chloro-2-oxopyridine-3-carboxylic acidMFCD001402881-benzyl-5-chloro-2-oxo-1,2-dihydro-3- pyridinecarboxylic acid3-Pyridinecarboxylic acid, 5-chloro-1,2-dihydro-2-oxo-1-(phenylmethyl)-Oprea1_1792321-benzyl-5-chloro-2-oxo-pyridine-3-carboxylic AcidSCHEMBL2285071HPIOWOMSNUANFN-UHFFFAOYSA-NSBB102715
Show more names
AKOS0050711718E-321S5-chloro-2-oxo-1-benzylhydropyridine-3-carboxylic acid1-benzyl-5-chloro 2-oxo-1,2-dihydropyridine-3-carboxylic acid1-Benzyl-5-chloro-2-oxo-1,2-dihydropyridine-3-carboxylicacid
Database identifiers
- PubChem CID
- 2764352
- Nikkaji
- J2.954.320H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 422
Related reactions
2 records
Compound notes
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