2-Ethyl-5-hexylfuran-3-sulfonic acid

Base Information

• Chemical Name: 2-Ethyl-5-hexylfuran-3-sulfonic acid
• CAS No.: 114625-58-0
• Molecular Formula: C12H20O4S
• DSSTox Substance ID: DTXSID80560096
• Wikidata: Q82443080
• Mol file: 114625-58-0.mol

Synonyms:2-ETHYL-5-HEXYLFURAN-3-SULFONIC ACID;114625-58-0;SCHEMBL22465829;DTXSID80560096

Chemical Property of 2-Ethyl-5-hexylfuran-3-sulfonic acid

Chemical Property:

• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 260.10823029
• Heavy Atom Count: 17
• Complexity: 307

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC1=CC(=C(O1)CC)S(=O)(=O)O

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