Basic information
- CAS
33028-62-5- Standard SMILES
CCn1cc(C(=O)O)c(=O)c2ccc3ccccc3c21- InChIKey
PRMOSQPDBLYTOV-UHFFFAOYSA-N- Molecular formula
- C16H13NO3
- Average molar mass
- 267.28 g/mol
- Monoisotopic mass
- 267.08954328
Names & identifiers
- Preferred name
- 1-Ethyl-4-oxobenzo[h]quinoline-3-carboxylic acid
- IUPAC
- 1-ethyl-4-oxobenzo[h]quinoline-3-carboxylic acid
Names & synonyms
33028-62-51-ethyl-4-oxobenzo[h]quinoline-3-carboxylic acidNSC199387DTXSID00307965NSC-1993871-Ethyl-4-oxo-1,4-dihydrobenzo[h]quinoline-3-carboxylic acid
Database identifiers
- CAS
33028-62-5- PubChem CID
- 304615
- DTXSID
DTXSID00307965
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 457
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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