Cyclooctane | SBID = 1212 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 0.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 4.5 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 0.0 | ||
| Number of H-Bond Acceptors: | 0.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 101.0 | ||
| Sum Formula: | C8H16 | ||
| M / g/mol: | 112.21 | ||
| Complexity: | 24.0 | ||
| Number of Conformers: | 2.0 |
Identifiers
- Tags: alicyclic
- Name: Cyclooctane
- Preferred Abbreviation: Cyclooctane
- IUPAC Name: cyclooctane
- CAS: 292-64-8
- CID: 9266
- InChiKey: WJTCGQSWYFHTAC-UHFFFAOYSA-N
- InChi: InChI=1S/C8H16/c1-2-4-6-8-7-5-3-1/h1-8H2
- CanoSmiles: C1CCCCCCC1
- IsoSmiles: C1CCCCCCC1
