Bis(4-methylphenyl) benzene-1,3-disulfonate

Base Information

• Chemical Name: Bis(4-methylphenyl) benzene-1,3-disulfonate
• CAS No.: 26841-13-4
• Molecular Formula: C20H18 O6 S2
• Molecular Weight: 418.4833
• NSC Number: 86035
• DSSTox Substance ID: DTXSID70292839
• Wikidata: Q82031312

Synonyms:bis(4-methylphenyl) benzene-1,3-disulfonate;26841-13-4;NSC86035;DTXSID70292839;NSC-86035;1,3-BIS(4-METHYLPHENYL) BENZENE-1,3-DISULFONATE

Chemical Property of Bis(4-methylphenyl) benzene-1,3-disulfonate

Chemical Property:

• Vapor Pressure: 3.76E-14mmHg at 25°C
• Boiling Point: 609.6°Cat760mmHg
• Flash Point: 322.5°C
• Density: 1.352g/cm³
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 418.05448064
• Heavy Atom Count: 28
• Complexity: 630

Purity/Quality:

99% ^*data from raw suppliers

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Useful:

• Canonical SMILES: CC1=CC=C(C=C1)OS(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)OC3=CC=C(C=C3)C

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