Hexylamine | SBID = 960 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 26.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 2.1 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| 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: | 93.1 | ||
| Sum Formula: | C6H15N | ||
| M / g/mol: | 101.19 | ||
| Complexity: | 27.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags:
- Name: Hexylamine
- Preferred Abbreviation: Hexylamine
- IUPAC Name: hexan-1-amine
- CAS: 111-26-2
- CID: 8102
- InChiKey: BMVXCPBXGZKUPN-UHFFFAOYSA-N
- InChi: InChI=1S/C6H15N/c1-2-3-4-5-6-7/h2-7H2,1H3
- CanoSmiles: CCCCCCN
- IsoSmiles: CCCCCCN
