Chemical Name - 4-Iodophenol
Mol Weight - 220.005
Smiles - Oc(cc1)ccc1I
Mol Weight - 220.005
Smiles - Oc(cc1)ccc1I
| Property Value | |
| Mol Name | 4-Iodophenol |
| Molweight | 220.005 |
| Monoisotopic Mass | 219.938513 |
| Clogp | 1.751 |
| Clogs | -2.336 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 105.89 |
| Relative Psa | 0.12371 |
| Polar Surface Area | 20.23 |
| Druglikeness | -0.95319 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.75 |
| Molecular Complexity | 0.59947 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 1 |
| Symmetric Atoms | 2 |
| Smiles | Oc(cc1)ccc1I |
| InChIKey | InChI=1S/C6H5IO/c7-5-1-3-6(8)4-2-5/h1-4,8H |
| InChI | VSMDINRNYYEDRN-UHFFFAOYSA-N |
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