- InChI
- InChI=1S/C7H7O/c1-6-2-4-7(8)5-3-6/h2-5H,1H3
- InChI Key
- LTKOYWPELWFYHK-UHFFFAOYSA-N
- Formula
- C7H7O
- SMILES
- Cc1ccc([O])cc1
- Molecular Weight1
- 107.13
- CAS
- 3174-48-9
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 884.50 | kJ/mol | NIST |
| BasG | 852.00 | kJ/mol | NIST |
| log10WS | -6.12 | Crippen Calculated Property | |
| logPoct/wat | 2.139 | Crippen Calculated Property | |
| McVol | 89.450 | ml/mol | McGowan Calculated Property |
Similar Compounds
Find more compounds similar to 4-Me-phenoxy.
Sources
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