Chemical Name - Heptyl Alcohol
Mol Weight - 116.203
Smiles - CCCCCCCO
Mol Weight - 116.203
Smiles - CCCCCCCO
| Property Value | |
| Mol Name | Heptyl Alcohol |
| Molweight | 116.203 |
| Monoisotopic Mass | 116.120115 |
| Clogp | 2.3225 |
| Clogs | -1.827 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 114.67 |
| Relative Psa | 0.11424 |
| Polar Surface Area | 20.23 |
| Druglikeness | -27.026 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Shape Index | 1 |
| Molecular Flexibility | 0.53766 |
| Molecular Complexity | 0.53648 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bonds | 5 |
| Sp3 Atoms | 8 |
| Smiles | CCCCCCCO |
| InChIKey | |
| InChI | C7H16O |
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1 - Heptyl Alcohol
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