Basic information
- CAS
5445-53-4- Standard SMILES
C[C@@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1C- InChIKey
GRTRADNNJCLYFO-CCHVVGMOSA-N- Molecular formula
- C18H18
- Average molar mass
- 234.3 g/mol
- Monoisotopic mass
- 234.14085057
Names & identifiers
- Preferred name
- (15R,16S)-15,16-dimethyltetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene
- IUPAC
- (15R,16S)-15,16-dimethyltetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene
Names & synonyms
5445-53-4NSC22091NSC-22091
Database identifiers
- CAS
5445-53-4- PubChem CID
- 228908
- Nikkaji
- J889.576G
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…