Chemical Name - Phenol
Mol Weight - 94.1126
Smiles - Oc1ccccc1
Mol Weight - 94.1126
Smiles - Oc1ccccc1
| Property Value | |
| Mol Name | Phenol |
| Molweight | 94.1126 |
| Monoisotopic Mass | 94.041865 |
| Clogp | 1.3139 |
| Clogs | -1.32 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 79.61 |
| Relative Psa | 0.16455 |
| Polar Surface Area | 20.23 |
| Druglikeness | -2.2721 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.71429 |
| Molecular Complexity | 0.64864 |
| Fragments | 1 |
| Non H Atoms | 7 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 1 |
| Symmetric Atoms | 2 |
| Smiles | Oc1ccccc1 |
| InChIKey | |
| InChI | C6H6O |
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