Mol Weight - 248.258
Smiles - OS(c(cc1)cc2c1oc1c2cccc1)(=O)=O
| Property Name | Property Value |
| Mol Name | Dibenzofuran-2-sulfonic Acid |
| Molweight | 248.258 |
| Monoisotopic Mass | 248.01433 |
| Clogp | 1.1988 |
| Clogs | -2.882 |
| H Acceptors | 4 |
| H Donors | 1 |
| Total Surface Area | 167.08 |
| Relative Psa | 0.33391 |
| Polar Surface Area | 75.89 |
| Druglikeness | -0.94549 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.52941 |
| Molecular Flexibility | 0.23977 |
| Molecular Complexity | 0.81145 |
| Fragments | 1 |
| Non H Atoms | 17 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bonds | 1 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 13 |
| Sp3 Atoms | 2 |
| Symmetric Atoms | 1 |
| Acidic Oxygens | 1 |
| Smiles | OS(c(cc1)cc2c1oc1c2cccc1)(=O)=O |
| InChIKey | InChI=1S/C12H8O4S/c13-17(14,15)8-5-6-12-10(7-8)9-3-1-2-4-11(9)16-12/h1-7H,(H,13,14,15) |
| InChI | JANFYPHFIPGYTQ-UHFFFAOYSA-N |
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1 — Dibenzofuran-2-sulfonic Acid | 2 — Dibenzofuran-2-sulfonic Acid