5-oxylato-5h-dibenzophosphole 5-oxide | SBID = 1959 | Compound |
Structure
Molecular Properties
| Interactions: | 0 | ||
| PubChem TPSA/Å2: | 40.1 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 1.6 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | -1.0 | ||
| 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: | 164.3 | ||
| Sum Formula: | C12H8O2P- | ||
| M / g/mol: | 215.16 | ||
| Complexity: | 268.0 | ||
| Number of Conformers: | 1.0 |
Identifiers
- Tags: aromatic, anion, typical guest, charged
- Name: 5-oxylato-5h-dibenzophosphole 5-oxide
- Preferred Abbreviation: 5-oxylato-5h-dibenzophosphole 5-oxide
- IUPAC Name: 5-oxidobenzo[b]phosphindole 5-oxide
- CAS:
- CID: 101738098
- InChiKey: IDEIKMWDUBOODW-UHFFFAOYSA-M
- InChi: InChI=1S/C12H9O2P/c13-15(14)11-7-3-1-5-9(11)10-6-2-4-8-12(10)15/h1-8H,(H,13,14)/p-1
- CanoSmiles: C1=CC=C2C(=C1)C3=CC=CC=C3P2(=O)[O-]
- IsoSmiles: C1=CC=C2C(=C1)C3=CC=CC=C3P2(=O)[O-]
