2-(Octane-1-sulfonyl)butanedioic acid

Base Information

• Chemical Name: 2-(Octane-1-sulfonyl)butanedioic acid
• CAS No.: 60713-19-1
• Molecular Formula: C12H22O6S
• DSSTox Substance ID: DTXSID20577148

Synonyms:60713-19-1;2-(OCTANE-1-SULFONYL)BUTANEDIOIC ACID;SCHEMBL5056520;DTXSID20577148

Chemical Property of 2-(Octane-1-sulfonyl)butanedioic acid

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 294.11370959
• Heavy Atom Count: 19
• Complexity: 382

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCS(=O)(=O)C(CC(=O)O)C(=O)O

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