2-(Decane-1-sulfonyl)butanedioic acid

Base Information

• Chemical Name: 2-(Decane-1-sulfonyl)butanedioic acid
• CAS No.: 60713-20-4
• Molecular Formula: C14H26O6S
• Molecular Weight: 322.41800
• DSSTox Substance ID: DTXSID80577149

Synonyms:60713-20-4;2-(DECANE-1-SULFONYL)BUTANEDIOIC ACID;n-decylsulfonylsuccinic acid;SCHEMBL9341038;DTXSID80577149;WESCJHHMQFZNKL-UHFFFAOYSA-N

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

Chemical Property:

• Boiling Point: 494.2±35.0 °C(Predicted)
• PSA: 117.12000
• Density: 1.192±0.06 g/cm3(Predicted)
• LogP: 3.55060
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 13
• Exact Mass: 322.14500972
• Heavy Atom Count: 21
• Complexity: 410

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

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