6-Methylgona-1,3,5(10),6,8,13-hexaen-17-one
Basic information
- CAS
27343-49-3- Standard SMILES
Cc1cc2c(c3ccccc13)CCC1=C2CCC1=O- InChIKey
OQXFCIXNNKWXGV-UHFFFAOYSA-N- Molecular formula
- C18H16O
- Average molar mass
- 248.3 g/mol
- Monoisotopic mass
- 248.12011513
Names & identifiers
- Preferred name
- 6-Methylgona-1,3,5(10),6,8,13-hexaen-17-one
- IUPAC
- 6-methyl-11,12,15,16-tetrahydrocyclopenta[a]phenanthren-17-one
Names & synonyms
27343-49-3Gona-1,3,5(10),6,8,13-hexaen-17-one, 6-methyl-6-Methylgona-1,3,5(10),6,8,13-hexaen-17-oneDTXSID001817826-methylgona-1(10),2,4,6,8,13-hexaen-17-one
Database identifiers
- CAS
27343-49-3- PubChem CID
- 185607
- DTXSID
DTXSID00181782
Properties
Computed structural properties
- XLogP
- 3.6
- 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
- 433
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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