6-Oxabicyclo[3.1.0]hexane | SBID = 700 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 12.5 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 0.8 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 0.0 | ||
| Number of H-Bond Acceptors: | 1.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 2.0 | ||
| 3D Volume/Å3: | 70.9 | ||
| Sum Formula: | C5H8O | ||
| M / g/mol: | 84.12 | ||
| Complexity: | 62.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: typical guest
- Name: 6-Oxabicyclo[3.1.0]hexane
- Preferred Abbreviation: Cyclopentene oxide
- IUPAC Name: 6-oxabicyclo[3.1.0]hexane
- CAS: 285-67-6
- CID: 9244
- InChiKey: GJEZBVHHZQAEDB-UHFFFAOYSA-N
- InChi: InChI=1S/C5H8O/c1-2-4-5(3-1)6-4/h4-5H,1-3H2
- CanoSmiles: C1CC2C(C1)O2
- IsoSmiles: C1CC2C(C1)O2
