Cyclopenta(a)phenanthren-17-one, 15,16-dihydro-11-ethyl-
Basic information
- CAS
42028-27-3- Standard SMILES
CCc1cc2c(c3ccc4ccccc4c13)CCC2=O- InChIKey
HJNQTKMCJWLPNJ-UHFFFAOYSA-N- Molecular formula
- C19H16O
- Average molar mass
- 260.3 g/mol
- Monoisotopic mass
- 260.12011513
Names & identifiers
- Preferred name
- Cyclopenta(a)phenanthren-17-one, 15,16-dihydro-11-ethyl-
- IUPAC
- 11-ethyl-15,16-dihydrocyclopenta[a]phenanthren-17-one
- English name
- 15,16-Dihydro-11-ethyl-17H-cyclopenta[a]phenanthren-17-one
- Molecular formula
- C19H16O
- Molecular weight
- 0
Names & synonyms
BRN 595759742028-27-3Cyclopenta(a)phenanthren-17-one, 15,16-dihydro-11-ethyl-11-Ethyl-15,16-dihydro-17H-cyclopenta(a)phenanthren-17-one15,16-Dihydro-11-ethylcyclopenta(a)phenanthren-17-oneDTXSID80194855RefChem:335830DTXCID2011734615,16-Dihydro-11-ethyl-17H-cyclopenta[a]phenanthren-17-one11-ethylgona-1(10),2,4,6,8,11,13-heptaen-17-one11-ethylcyclopentaphenanthrene-17-one
Database identifiers
- CAS
42028-27-3- PubChem CID
- 148443
- DTXSID
DTXSID80194855- Nikkaji
- J74.711D
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 387
Physicochemical properties
- Boiling point
- 363.59 °C · 363.59°C (rough estimate)
- Density
- 1.0452 · 1.0452 (rough estimate)
- refractive index
- 1.622 · 1.6220 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…