1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-
Basic information
- CAS
66149-44-8- Standard SMILES
CC(C)=C1C2CCC3CCC1C32- InChIKey
VOHHJWBRHSIESM-UHFFFAOYSA-N- Molecular formula
- C12H18
- Average molar mass
- 162.27 g/mol
- Monoisotopic mass
- 162.14085057
Names & identifiers
- Preferred name
- 1H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-
- IUPAC
- 2-propan-2-ylidenetricyclo[4.2.1.03,9]nonane
Names & synonyms
66149-44-81H-Cyclobuta(cd)pentalene, octahydro-1-(1-methylethylidene)-DTXSID509846291H-Cyclobuta[cd]pentalene,octahydro-1-(1-methylethylidene)-1-(propan-2-ylidene)octahydro-1H-cyclobuta[cd]pentalene
Database identifiers
- CAS
66149-44-8- PubChem CID
- 144162
- DTXSID
DTXSID50984629
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 227
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…