benzoselenazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt
3-(2-methyl-1,3-benzoselenazol-3-ium-3-yl)propane-1-sulfonate
Also Known As: 3-2-methylbenzoselenazol-3-ium|3- -2-methylbenzoselenazol-3-ium|Benzoselenazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt|3-(3-Sulfonatopropyl)-2-methylbenzoselenazol-3-ium|Benzoselenazolium, 2-methyl-3-(3-sulfopropyl)-, hydroxide, inner salt|3-(2-methyl-1,3-benzoselenazol-3-ium-3-yl)propane-1-sulfonate|2-METHYL-3-(3-SULFONATOPROPYL)-1,3-BENZOSELENAZOL-3-IUM
| Molecular Formula | C11H13NO3SSe |
|---|---|
| Molecular Weight | 318.97815 g/mol |
| LogP | 0.43 |
| Topological Polar Surface Area | 61.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.97815 |
| Heavy Atoms | 17 |
| Complexity | 633.2 |
Chemical Identifiers
| CAS Number | 29680-54-4 |
|---|---|
| SMILES | CC1=[N+](C2=CC=CC=C2[Se]1)CCCS(=O)(=O)[O-] |
Product Overview
benzoselenazolium, 2-methyl-3-(3-sulfopropyl)-, inner salt (CAS 29680-54-4), with molecular formula C11H13NO3SSe and molecular weight 318.97815 g/mol. IUPAC: 3-(2-methyl-1,3-benzoselenazol-3-ium-3-yl)propane-1-sulfonate.
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