2-Hydroxy-5-nonylbenzene-1-sulfonic acid

Base Information

• Chemical Name: 2-Hydroxy-5-nonylbenzene-1-sulfonic acid
• CAS No.: 56396-93-1
• Molecular Formula: C15H24O4S
• Molecular Weight: 300.41400
• DSSTox Substance ID: DTXSID70597573
• Nikkaji Number: J28.735K
• Wikidata: Q82493174

Synonyms:56396-93-1;SCHEMBL8370440;DTXSID70597573;2-Hydroxy-5-nonylbenzene-1-sulfonic acid

Chemical Property of 2-Hydroxy-5-nonylbenzene-1-sulfonic acid

Chemical Property:

• PSA: 82.98000
• LogP: 5.01280
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 300.13953042
• Heavy Atom Count: 20
• Complexity: 347

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCC1=CC(=C(C=C1)O)S(=O)(=O)O

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