Chemical Name - Methyl Cyclohexanol
Mol Weight - 114.187
Smiles - CC1(CCCCC1)O
Mol Weight - 114.187
Smiles - CC1(CCCCC1)O
| Property Value | |
| Mol Name | Methyl Cyclohexanol |
| Molweight | 114.187 |
| Monoisotopic Mass | 114.104465 |
| Clogp | 1.4979 |
| Clogs | -1.86 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 97.82 |
| Relative Psa | 0.13392 |
| Polar Surface Area | 20.23 |
| Druglikeness | -3.7369 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.625 |
| Molecular Flexibility | 0.19379 |
| Molecular Complexity | 0.57565 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 8 |
| Symmetric Atoms | 2 |
| Smiles | CC1(CCCCC1)O |
| InChIKey | InChI=1S/C7H14O/c1-7(8)5-3-2-4-6-7/h8H,2-6H2,1H3 |
| InChI | VTBOTOBFGSVRMA-UHFFFAOYSA-N |
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1 - Methyl Cyclohexanol
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1 - Methyl Cyclohexanol
2 - Methyl Cyclohexanol
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