Pyridine | SBID = 1123 | Compound |
Structure
Molecular Properties
| Interactions: | 8 | ||
| PubChem TPSA/Å2: | 12.9 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 0.7 | ||
| 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: | 67.7 | ||
| Sum Formula: | C5H5N | ||
| M / g/mol: | 79.1 | ||
| Complexity: | 30.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: aromatic, typical guest
- Name: Pyridine
- Preferred Abbreviation: Pyridine
- IUPAC Name: pyridine
- CAS: 110-86-1
- CID: 1049
- InChiKey: JUJWROOIHBZHMG-UHFFFAOYSA-N
- InChi: InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H
- CanoSmiles: C1=CC=NC=C1
- IsoSmiles: C1=CC=NC=C1
