2,7-Dihydroxynaphthalene | SBID = 130 | Compound |
Structure
Molecular Properties
| Interactions: | 4 | ||
| PubChem TPSA/Å2: | 40.5 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 2.3 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 2.0 | ||
| 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: | 127.2 | ||
| Sum Formula: | C10H8O2 | ||
| M / g/mol: | 160.172 | ||
| Complexity: | 142.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: aromatic, typical guest
- Name: 2,7-Dihydroxynaphthalene
- Preferred Abbreviation: 2,7-Dihydroxynaphthalene
- IUPAC Name: naphthalene-2,7-diol
- CAS: 582-17-2
- CID: 11397
- InChiKey: DFQICHCWIIJABH-UHFFFAOYSA-N
- InChi: InChI=1S/C10H8O2/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1-6,11-12H
- CanoSmiles: C1=CC(=CC2=C1C=CC(=C2)O)O
- IsoSmiles: C1=CC(=CC2=C1C=CC(=C2)O)O
