Propane | SBID = 310 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 0.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 1.8 | ||
| 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: | 46.4 | ||
| Sum Formula: | C3H8 | ||
| M / g/mol: | 44.097 | ||
| Complexity: | 0.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: aliphatic, alkane, hydrocarbon, typical guest
- Name: Propane
- Preferred Abbreviation: Propane
- IUPAC Name: propane
- CAS: 74-98-6
- CID: 6334
- InChiKey: ATUOYWHBWRKTHZ-UHFFFAOYSA-N
- InChi: InChI=1S/C3H8/c1-3-2/h3H2,1-2H3
- CanoSmiles: CCC
- IsoSmiles: CCC
