trans-4-methylcyclohexyl(trimethyl)ammonium | SBID = 1046 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 0.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 2.5 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 1.0 | ||
| 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: | 136.8 | ||
| Sum Formula: | C10H22N+ | ||
| M / g/mol: | 156.29 | ||
| Complexity: | 115.0 | ||
| Number of Conformers: | 7.0 |
Identifiers
- Tags: cation, typical guest, charged
- Name: trans-4-methylcyclohexyl(trimethyl)ammonium
- Preferred Abbreviation: trans-4-methylcyclohexyl(trimethyl)ammonium
- IUPAC Name: trimethyl-(4-methylcyclohexyl)azanium
- CAS: 727966-22-5
- CID: 90346879
- InChiKey: IZZPJNHNACZYOG-UHFFFAOYSA-N
- InChi: InChI=1S/C10H22N/c1-9-5-7-10(8-6-9)11(2,3)4/h9-10H,5-8H2,1-4H3/q+1
- CanoSmiles: CC1CCC(CC1)[N+](C)(C)C
- IsoSmiles: CC1CCC(CC1)[N+](C)(C)C
