3-Methoxyphenol | SBID = 278 | Compound |
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | 29.5 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | 1.6 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 1.0 | ||
| 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: | 100.3 | ||
| Sum Formula: | C7H8O2 | ||
| M / g/mol: | 124.139 | ||
| Complexity: | 83.0 | ||
| Number of Conformers: | 2.0 |
Identifiers
- Tags: aromatic
- Name: 3-Methoxyphenol
- Preferred Abbreviation: 3-Methoxyphenol
- IUPAC Name: 3-methoxyphenol
- CAS: 150-19-6
- CID: 9007
- InChiKey: ASHGTJPOSUFTGB-UHFFFAOYSA-N
- InChi: InChI=1S/C7H8O2/c1-9-7-4-2-3-6(8)5-7/h2-5,8H,1H3
- CanoSmiles: COC1=CC=CC(=C1)O
- IsoSmiles: COC1=CC=CC(=C1)O
