oxidane | SBID = 2122 | Compound |
Structure
Molecular Properties
| Interactions: | 3 | ||
| PubChem TPSA/Å2: | 1.0 | ||
| Ertl TPSA/Å2: | 0.0 | ||
| Hydrophilicity (PubChem XLogP): | -0.5 | ||
| Hydrophilicity (Cheng XLogP3): | 0.0 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 1.0 | ||
| Number of H-Bond Acceptors: | 1.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 14.7 | ||
| Sum Formula: | H2O | ||
| M / g/mol: | 18.015 | ||
| Complexity: | 0.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags:
- Name: oxidane
- Preferred Abbreviation: water
- IUPAC Name: oxidane
- CAS:
- CID: 962
- InChiKey: XLYOFNOQVPJJNP-UHFFFAOYSA-N
- InChi: InChI=1S/H2O/h1H2
- CanoSmiles: O
- IsoSmiles: O
