4-Hydroxy-2-methyl-3-nitrobenzene-1-sulfonic acid

Base Information

• Chemical Name: 4-Hydroxy-2-methyl-3-nitrobenzene-1-sulfonic acid
• CAS No.: 62351-46-6
• Molecular Formula: C7H7NO6S
• Molecular Weight: 233.19900
• DSSTox Substance ID: DTXSID10491309
• Wikidata: Q82335709

Synonyms:62351-46-6;4-Hydroxy-2-methyl-3-nitrobenzene-1-sulfonic acid;DTXSID10491309

Chemical Property of 4-Hydroxy-2-methyl-3-nitrobenzene-1-sulfonic acid

Chemical Property:

• PSA: 128.80000
• LogP: 2.45950
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 232.99940812
• Heavy Atom Count: 15
• Complexity: 342

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1[N+](=O)[O-])O)S(=O)(=O)O

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