Chemical Name - Methyl Trifluoromethanesulfonate
Mol Weight - 164.103
Smiles - COS(C(F)(F)F)(=O)=O
Mol Weight - 164.103
Smiles - COS(C(F)(F)F)(=O)=O
| Property Value | |
| Mol Name | Methyl Trifluoromethanesulfonate |
| Molweight | 164.103 |
| Monoisotopic Mass | 163.975499 |
| Clogp | 1.6836 |
| Clogs | -1.39 |
| H Acceptors | 3 |
| Total Surface Area | 93.8 |
| Relative Psa | 0.4113 |
| Polar Surface Area | 51.75 |
| Druglikeness | -33.505 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | low |
| Irritant | low |
| Shape Index | 0.55556 |
| Molecular Flexibility | 0.74662 |
| Molecular Complexity | 0.62123 |
| Fragments | 1 |
| Non H Atoms | 9 |
| Non Ch Atoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bonds | 2 |
| Sp3 Atoms | 4 |
| Symmetric Atoms | 3 |
| Smiles | COS(C(F)(F)F)(=O)=O |
| InChIKey | InChI=1S/C2H3F3O3S/c1-8-9(6,7)2(3,4)5/h1H3 |
| InChI | OIRDBPQYVWXNSJ-UHFFFAOYSA-N |
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1 - Methyl Trifluoromethanesulfonate
2 - Methyl Trifluoromethanesulfonate
1 - Methyl Trifluoromethanesulfonate
2 - Methyl Trifluoromethanesulfonate
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