Disodium 1-(1,3-dimethylbutyl) 2-sulphonatosuccinate

Base Information

• Chemical Name: Disodium 1-(1,3-dimethylbutyl) 2-sulphonatosuccinate
• CAS No.: 68797-49-9
• Molecular Formula: C10H18 O7 S . 2 Na
• Molecular Weight: 326.27438
• European Community (EC) Number: 272-301-7
• UNII: RY5N9CVH9N
• DSSTox Substance ID: DTXSID70988508
• Mol file: 68797-49-9.mol

Synonyms:68797-49-9;Butanedioic acid, sulfo-, 1-(1,3-dimethylbutyl) ester, disodium salt;Butanedioic acid, 2-sulfo-, 1-(1,3-dimethylbutyl) ester, sodium salt (1:2);Disodium 1-(1,3-dimethylbutyl) 2-sulphonatosuccinate;disodium 4-[(4-methylpentan-2-yl)oxy]-4-oxo-3-sulfonatobutanoate;EINECS 272-301-7;RY5N9CVH9N;DTXSID70988508;Disodium 1-(1,3-dimethylbutyl) 2-sulfonatosuccinate

Chemical Property of Disodium 1-(1,3-dimethylbutyl) 2-sulphonatosuccinate

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 326.04121258
• Heavy Atom Count: 20
• Complexity: 374

Purity/Quality:

99% ^*data from raw suppliers

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Useful:

• Canonical SMILES: CC(C)CC(C)OC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+]

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