Ethyl 4-ethoxyquinoline-3-carboxylate
Basic information
- CAS
13720-96-2- Standard SMILES
CCOC(=O)c1cnc2ccccc2c1OCC- InChIKey
HXIUQCPRCKSUGB-UHFFFAOYSA-N- Molecular formula
- C14H15NO3
- Average molar mass
- 245.27 g/mol
- Monoisotopic mass
- 245.10519334
Names & identifiers
- Preferred name
- Ethyl 4-ethoxyquinoline-3-carboxylate
- IUPAC
- ethyl 4-ethoxyquinoline-3-carboxylate
Names & synonyms
ethyl 4-ethoxyquinoline-3-carboxylate13720-96-2NSC136912SCHEMBL5504475HXIUQCPRCKSUGB-UHFFFAOYSA-DTXSID80300414NSC-136912DS-011050InChI=1/C14H15NO3/c1-3-17-13-10-7-5-6-8-12(10)15-9-11(13)14(16)18-4-2/h5-9H,3-4H2,1-2H3
Database identifiers
- CAS
13720-96-2- PubChem CID
- 282840
- DTXSID
DTXSID80300414
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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