3-(4-Chloro-3-methylphenoxy)propane-1-sulfonic acid

Base Information

• Chemical Name: 3-(4-Chloro-3-methylphenoxy)propane-1-sulfonic acid
• CAS No.: 85163-61-7
• Molecular Formula: C10H13ClO4S
• DSSTox Substance ID: DTXSID30600471
• Wikidata: Q82496573

Synonyms:3-(4-Chloro-3-methylphenoxy)propane-1-sulfonic acid;85163-61-7;SCHEMBL10572709;DTXSID30600471

Chemical Property of 3-(4-Chloro-3-methylphenoxy)propane-1-sulfonic acid

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 264.0223078
• Heavy Atom Count: 16
• Complexity: 298

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)OCCCS(=O)(=O)O)Cl

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