1,2-Propylene oxide | SBID = 695 | Compound |
Structure
Molecular Properties
| Interactions: | 5 | ||
| PubChem TPSA/Å2: | 12.5 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 0.0 | ||
| 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): | 1.0 | ||
| 3D Volume/Å3: | 51.7 | ||
| Sum Formula: | C3H6O | ||
| M / g/mol: | 58.08 | ||
| Complexity: | 26.0 | ||
| Number of Conformers: | 2.0 |
Identifiers
- Tags: typical guest
- Name: 1,2-Propylene oxide
- Preferred Abbreviation: 2-Methyloxirane
- IUPAC Name: 2-methyloxirane
- CAS: 75-56-9
- CID: 6378
- InChiKey: GOOHAUXETOMSMM-UHFFFAOYSA-N
- InChi: InChI=1S/C3H6O/c1-3-2-4-3/h3H,2H2,1H3
- CanoSmiles: CC1CO1
- IsoSmiles: CC1CO1
