Mol Weight - 154.164
Smiles - O=C(C1C2CCCC1)OC2=O
| Property Name | Property Value |
| Mol Name | Hexa Hydro Phthalic Anhydride |
| Molweight | 154.164 |
| Monoisotopic Mass | 154.062995 |
| Clogp | 0.343 |
| Clogs | -1.901 |
| H Acceptors | 3 |
| Total Surface Area | 112.04 |
| Relative Psa | 0.32203 |
| Polar Surface Area | 43.37 |
| Druglikeness | -20.687 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 0.54545 |
| Molecular Flexibility | 0.17936 |
| Molecular Complexity | 0.71278 |
| Fragments | 1 |
| Non H Atoms | 11 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Stereo Centers | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Sp3 Atoms | 7 |
| Symmetric Atoms | 5 |
| Smiles | O=C(C1C2CCCC1)OC2=O |
| InChIKey | InChI=1S/C8H10O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h5-6H,1-4H2 |
| InChI | MUTGBJKUEZFXGO-UHFFFAOYSA-N |
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1 — Hexa Hydro Phthalic Anhydride | 2 — Hexa Hydro Phthalic Anhydride