Bromocyclohexane | SBID = 1087 | Compound |
Structure
Molecular Properties
| Interactions: | 5 | ||
| PubChem TPSA/Å2: | 0.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 3.2 | ||
| 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: | 97.0 | ||
| Sum Formula: | C6H11Br | ||
| M / g/mol: | 163.06 | ||
| Complexity: | 46.0 | ||
| Number of Conformers: | 4.0 |
Identifiers
- Tags: typical guest
- Name: Bromocyclohexane
- Preferred Abbreviation: Bromocyclohexane
- IUPAC Name: bromocyclohexane
- CAS: 108-85-0
- CID: 7960
- InChiKey: AQNQQHJNRPDOQV-UHFFFAOYSA-N
- InChi: InChI=1S/C6H11Br/c7-6-4-2-1-3-5-6/h6H,1-5H2
- CanoSmiles: C1CCC(CC1)Br
- IsoSmiles: C1CCC(CC1)Br
