2-((Methylthio)methyl)-1H-benzimidazole-5-sulphonic acid
2-(methylsulfanylmethyl)-3H-benzimidazole-5-sulfonic acid
Also Known As: EINECS 249-665-0|2-((Methylthio)methyl)-1H-benzimidazole-5-sulphonic acid|2-[ methyl]-1H-benzimidazole-5-sulphonicacid|2-[(Methylthio)methyl]-1H-benzimidazole-5-sulfonic acid|2-[(METHYLTHIO)METHYL]-1H-BENZIMIDAZOLE-5-SULPHONIC ACID|1H-Benzimidazole-5-sulfonic acid, 2-((methylthio)methyl)-|1H-Benzimidazole-6-sulfonicacid, 2-[(methylthio)methyl]-|2-(methylsulfanylmethyl)-3H-benzimidazole-5-sulfonic acid|2-[(Methylsulfanyl)methyl]-1H-1,3-benzimidazole-6-sulfonic acid|2-[(METHYLSULFANYL)METHYL]-1H-1,3-BENZODIAZOLE-5-SULFONIC ACID
| Molecular Formula | C9H10N2O3S2 |
|---|---|
| Molecular Weight | 258.01328 g/mol |
| LogP | 1.67 |
| Topological Polar Surface Area | 83.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.01328 |
| Heavy Atoms | 16 |
| Complexity | 618.7 |
Chemical Identifiers
| CAS Number | 29490-03-7 |
|---|---|
| SMILES | CSCC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)O |
Product Overview
2-((Methylthio)methyl)-1H-benzimidazole-5-sulphonic acid (CAS 29490-03-7), with molecular formula C9H10N2O3S2 and molecular weight 258.01328 g/mol. IUPAC: 2-(methylsulfanylmethyl)-3H-benzimidazole-5-sulfonic acid.
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