Chemical Name - Sodium Methane Sulphonate
Mol Weight - 95.0978
Smiles - CS([O-])(=O)=O.[Na+]
Mol Weight - 95.0978
Smiles - CS([O-])(=O)=O.[Na+]
| Property Value | |
| Mol Name | Sodium Methane Sulphonate |
| Molweight | 95.0978 |
| Monoisotopic Mass | 94.98029 |
| Clogp | -3.0677 |
| Clogs | 0.024 |
| H Acceptors | 3 |
| Total Surface Area | 61.87 |
| Relative Psa | 0.69274 |
| Polar Surface Area | 65.58 |
| Druglikeness | -5.1124 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.6 |
| Molecular Complexity | 0.89588 |
| Fragments | 2 |
| Non H Atoms | 5 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Sp3 Atoms | 3 |
| Symmetric Atoms | 1 |
| Acidic Oxygens | 1 |
| Smiles | CS([O-])(=O)=O.[Na+] |
| InChIKey | InChI=1S/CH4O3S.Na/c1-5(2,3)4;/h1H3,(H,2,3,4);/q;+1/p-1 |
| InChI | KKVTYAVXTDIPAP-UHFFFAOYSA-M |
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1 - Sodium Methane Sulphonate
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1 - Sodium Methane Sulphonate
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