1-Iodopentane | SBID = 1216 | Compound |
Structure
Molecular Properties
| Interactions: | 3 | ||
| PubChem TPSA/Å2: | 0.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 3.6 | ||
| 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: | 99.3 | ||
| Sum Formula: | C5H11I | ||
| M / g/mol: | 198.05 | ||
| Complexity: | 19.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: typical guest
- Name: 1-Iodopentane
- Preferred Abbreviation: 1-Iodopentane
- IUPAC Name: 1-iodopentane
- CAS: 628-17-1
- CID: 12335
- InChiKey: BLXSFCHWMBESKV-UHFFFAOYSA-N
- InChi: InChI=1S/C5H11I/c1-2-3-4-5-6/h2-5H2,1H3
- CanoSmiles: CCCCCI
- IsoSmiles: CCCCCI
