3-Hydroxy-2-methylbenzenesulfonic acid

Base Information

• Chemical Name: 3-Hydroxy-2-methylbenzenesulfonic acid
• CAS No.: 102014-38-0
• Molecular Formula: C7H8O4S
• Molecular Weight: 188.2
• UNII: ZBC4E56H95
• DSSTox Substance ID: DTXSID701018158
• Nikkaji Number: J163.808D
• Wikidata: Q27295257
• Mol file: 102014-38-0.mol

Synonyms:3-hydroxy-2-methylbenzenesulfonic acid;o-Cresol-3-sulfonic acid;102014-38-0;o-Toluenesulfonic acid, 3-hydroxy-;UNII-ZBC4E56H95;ZBC4E56H95;Benzenesulfonic acid, 3-hydroxy-2-methyl-;Kresolsulfosaure;Cresol sulfonic acid;SCHEMBL34452;BZOVBIIWPDQIHF-UHFFFAOYSA-N;DTXSID701018158;AKOS015897622;FT-0603176;Q27295257

Chemical Property of 3-Hydroxy-2-methylbenzenesulfonic acid

Chemical Property:

• PSA: 82.98000
• LogP: 2.02810
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 188.01432991
• Heavy Atom Count: 12
• Complexity: 241

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=CC=C1S(=O)(=O)O)O

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