4-methylbenzenesulfonate,3-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)propane-1-sulfonic acid
Modify Date: 2025-08-25 11:18:24
4-methylbenzenesulfonate,3-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)propane-1-sulfonic acid structure
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Common Name | 4-methylbenzenesulfonate,3-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)propane-1-sulfonic acid | ||
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| CAS Number | 926905-78-4 | Molecular Weight | 378.46400 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C14H22N2O6S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | 4-methylbenzenesulfonate,3-(1-methyl-1,2-dihydroimidazol-1-ium-3-yl)propane-1-sulfonic acid |
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| Molecular Formula | C14H22N2O6S2 |
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| Molecular Weight | 378.46400 |
| Exact Mass | 378.09200 |
| PSA | 131.98000 |
| LogP | 3.21950 |
| InChIKey | KPJCNLGGJOQSOX-UHFFFAOYSA-N |
| SMILES | C[NH+]1C=CN(CCCS(=O)(=O)O)C1.Cc1ccc(S(=O)(=O)[O-])cc1 |