Naphthalenesulfonic acid, ((hydroxy((4-hydroxy-3-methylphenyl)sulfonyl)methylphenyl)methyl)-

Base Information

• Chemical Name: Naphthalenesulfonic acid, ((hydroxy((4-hydroxy-3-methylphenyl)sulfonyl)methylphenyl)methyl)-
• CAS No.: 68400-77-1
• Molecular Formula: C25H22O7S2
• Molecular Weight: 498.568
• DSSTox Substance ID: DTXSID90987977
• Wikidata: Q82976369

Synonyms:68400-77-1;Naphthalenesulfonic acid, ((hydroxy((4-hydroxy-3-methylphenyl)sulfonyl)methylphenyl)methyl)-;Naphthalenesulfonic acid, [[hydroxy[(4-hydroxy-3-methylphenyl)sulfonyl]methylphenyl]methyl]-;DTXSID90987977;C25H22O7S2;C25-H22-O7-S2;2-{[4-Hydroxy-3-(4-hydroxy-3-methylbenzene-1-sulfonyl)-2-methylphenyl]methyl}naphthalene-1-sulfonic acid

Chemical Property of Naphthalenesulfonic acid, ((hydroxy((4-hydroxy-3-methylphenyl)sulfonyl)methylphenyl)methyl)-

Chemical Property:

• Density: 1.451g/cm³
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 498.08069538
• Heavy Atom Count: 34
• Complexity: 907

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)S(=O)(=O)C2=C(C=CC(=C2C)CC3=C(C4=CC=CC=C4C=C3)S(=O)(=O)O)O)O

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