2-Hydroxy-3-oxo-2,3-diphenylpropyl octane-1-sulfonate

Base Information

• Chemical Name: 2-Hydroxy-3-oxo-2,3-diphenylpropyl octane-1-sulfonate
• CAS No.: 83029-13-4
• Molecular Formula: C23H30O5S
• DSSTox Substance ID: DTXSID70599810
• Nikkaji Number: J2.718.106F

Synonyms:83029-13-4;SCHEMBL9575220;DTXSID70599810;2-HYDROXY-3-OXO-2,3-DIPHENYLPROPYL OCTANE-1-SULFONATE

Chemical Property of 2-Hydroxy-3-oxo-2,3-diphenylpropyl octane-1-sulfonate

Chemical Property:

• XLogP3: 5.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 13
• Exact Mass: 418.18139523
• Heavy Atom Count: 29
• Complexity: 571

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCS(=O)(=O)OCC(C1=CC=CC=C1)(C(=O)C2=CC=CC=C2)O

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