Basic information
- CAS
16992-94-2- Standard SMILES
CCOC(=O)C(=O)C1CCc2c(ccc3ccccc23)C1=O- InChIKey
DGMXRGBSORJOLJ-UHFFFAOYSA-N- Molecular formula
- C18H16O4
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.10485899
Names & identifiers
- Preferred name
- ethyl 2-oxo-2-(1-oxo-3,4-dihydro-2H-phenanthren-2-yl)acetate
- IUPAC
- ethyl 2-oxo-2-(1-oxo-3,4-dihydro-2H-phenanthren-2-yl)acetate
Names & synonyms
16992-94-2NSC159433ethyl oxo(1-oxo-1,2,3,4-tetrahydrophenanthren-2-yl)acetateethyl 2-oxo-2-(1-oxo-3,4-dihydro-2H-phenanthren-2-yl)acetateDTXSID20303626NSC-159433
Database identifiers
- CAS
16992-94-2- PubChem CID
- 293115
- DTXSID
DTXSID20303626
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 470
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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