2,6-dimethylpyridine | SBID = 1434 | Compound |
Structure
Molecular Properties
| Interactions: | 6 | ||
| PubChem TPSA/Å2: | 12.9 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 1.7 | ||
| 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): | 0.0 | ||
| 3D Volume/Å3: | 93.6 | ||
| Sum Formula: | C7H9N | ||
| M / g/mol: | 107.15 | ||
| Complexity: | 62.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: aromatic, typical guest
- Name: 2,6-dimethylpyridine
- Preferred Abbreviation: 2,6-Dimethylpyridine
- IUPAC Name: 2,6-dimethylpyridine
- CAS: 108-48-5
- CID: 7937
- InChiKey: OISVCGZHLKNMSJ-UHFFFAOYSA-N
- InChi: InChI=1S/C7H9N/c1-6-4-3-5-7(2)8-6/h3-5H,1-2H3
- CanoSmiles: CC1=NC(=CC=C1)C
- IsoSmiles: CC1=NC(=CC=C1)C
