2,3,4-Tris(octyloxy)benzene-1-sulfonic acid

Base Information

• Chemical Name: 2,3,4-Tris(octyloxy)benzene-1-sulfonic acid
• CAS No.: 113962-69-9
• Molecular Formula: C30H54O6S
• DSSTox Substance ID: DTXSID90579598
• Nikkaji Number: J2.764.899A
• Wikidata: Q82470172
• Mol file: 113962-69-9.mol

Synonyms:113962-69-9;2,3,4-Tris(octyloxy)benzene-1-sulfonic acid;trioctyloxybenzolsulfonic acid;DTXSID90579598

Chemical Property of 2,3,4-Tris(octyloxy)benzene-1-sulfonic acid

Chemical Property:

• XLogP3: 10.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 25
• Exact Mass: 542.36411061
• Heavy Atom Count: 37
• Complexity: 606

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOC1=C(C(=C(C=C1)S(=O)(=O)O)OCCCCCCCC)OCCCCCCCC

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