4,4'-Bipyridine | SBID = 1424 | Compound |
Structure
Molecular Properties
| Interactions: | 3 | ||
| PubChem TPSA/Å2: | 25.8 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 1.4 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 0.0 | ||
| Number of H-Bond Acceptors: | 2.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 126.8 | ||
| Sum Formula: | C10H8N2 | ||
| M / g/mol: | 156.18 | ||
| Complexity: | 108.0 | ||
| Number of Conformers: | 2.0 |
Identifiers
- Tags: aromatic, typical guest
- Name: 4,4'-Bipyridine
- Preferred Abbreviation: 4,4'-Dipyridine
- IUPAC Name: 4-pyridin-4-ylpyridine
- CAS: 553-26-4
- CID: 11107
- InChiKey: MWVTWFVJZLCBMC-UHFFFAOYSA-N
- InChi: InChI=1S/C10H8N2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8H
- CanoSmiles: C1=CN=CC=C1C2=CC=NC=C2
- IsoSmiles: C1=CN=CC=C1C2=CC=NC=C2
