Octahydropentalene
1,2,3,3a,4,5,6,6a-octahydropentalene
Also Known As: Pentalene, octahydro-|Octahydropentalene|Octahydro-pentalene|perhydropentalene|Bicyclo[3.3.0]octane|Bicyclo(3.3.0)octane|cis-Octahydropentalene|Octahydropentalene #|Pentalene, octahydro-, cis-|bicyclo[3,3,0]octane|BICYCLO OCTANE|Bicyclo(3,3,0)octane|trans-Octahydropentalene|cis-Bicyclo[3.3.0]octane|Octahydropentalene, (Z)-|trans-Bicyclo(3.3.0)octane|1,2,3,3a,4,5,6,6a-octahydropentalene|(3ar,6ar)-octahydropentalene|(3as,6as)-octahydropentalene|trans-Bicyclo[3.3.0]octane|(3aalpha,6aalpha)-Octahydropentalene|(Z)-Bicyclo[3.3.0]octane|Pentalene, octahydro-, trans-|Bicyclo[3.3.0]octane (cis)
| Molecular Formula | C1CC2CCCC2C1 |
|---|---|
| Molecular Weight | 110.10955 g/mol |
| LogP | 3.5 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.10955 |
| Monoisotopic Mass | 110.10955 |
| Heavy Atoms | 8 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 5597-89-7 |
|---|---|
| SMILES | C1CC2CCCC2C1 |
| InChIKey | AEBWATHAIVJLTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octahydropentalene (CAS 5597-89-7), with molecular formula C1CC2CCCC2C1 and molecular weight 110.10955 g/mol. IUPAC: 1,2,3,3a,4,5,6,6a-octahydropentalene.
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