4-[2-[2-(3,4-Dihydroxyphenyl)ethylsulfonylmethylsulfonyl]ethyl]benzene-1,2-diol

Base Information

• Chemical Name: 4-[2-[2-(3,4-Dihydroxyphenyl)ethylsulfonylmethylsulfonyl]ethyl]benzene-1,2-diol
• CAS No.: 919492-45-8
• Molecular Formula: C17H20O8S2
• ChEMBL ID: CHEMBL388725
• DSSTox Substance ID: DTXSID30582006
• Wikidata: Q82473326

Synonyms:CHEMBL388725;919492-45-8;4-[2-[2-(3,4-dihydroxyphenyl)ethylsulfonylmethylsulfonyl]ethyl]benzene-1,2-diol;SCHEMBL5377166;DTXSID30582006;1,2-Benzenediol, 4,4'-[methylenebis(sulfonyl-2,1-ethanediyl)]bis-;BDBM50197637;bis(2-(3,4-dihydroxyphenyl)-ethylsulfonyl)methane;4,4'-[Methylenebis(sulfonylethane-2,1-diyl)]di(benzene-1,2-diol)

Chemical Property of 4-[2-[2-(3,4-Dihydroxyphenyl)ethylsulfonylmethylsulfonyl]ethyl]benzene-1,2-diol

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 416.05995994
• Heavy Atom Count: 27
• Complexity: 606

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1CCS(=O)(=O)CS(=O)(=O)CCC2=CC(=C(C=C2)O)O)O)O

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