Basic information
- CAS
42123-02-4- Standard SMILES
CC1C(=O)Cc2c1ccc1c2ccc2ccccc21- InChIKey
YXASHNVNTNEYSE-UHFFFAOYSA-N- Molecular formula
- C18H14O
- Average molar mass
- 246.3 g/mol
- Monoisotopic mass
- 246.10446507
Names & identifiers
- Preferred name
- 16H-Cyclopenta(a)phenanthren-16-one, 15,17-dihydro-17-methyl-
- IUPAC
- 17-methyl-15,17-dihydrocyclopenta[a]phenanthren-16-one
Names & synonyms
42123-02-416H-Cyclopenta(a)phenanthren-16-one, 15,17-dihydro-17-methyl-DTXSID2096229217-Methylgona-1(10),2,4,6,8,11,13-heptaen-16-one
Database identifiers
- CAS
42123-02-4- PubChem CID
- 181720
- DTXSID
DTXSID20962292
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 374
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…