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Technology Process of 3,5,5-Trimethylhexanoyloxybenzene sulfonate

3,5,5-Trimethylhexanoyloxybenzene sulfonate

Base Information
  • Chemical Name:3,5,5-Trimethylhexanoyloxybenzene sulfonate
  • CAS No.:102568-17-2
  • Molecular Formula:C15H22 O5 S
  • Molecular Weight:0
  • Hs Code.:
  • DSSTox Substance ID:DTXSID60907708
  • Mol file:102568-17-2.mol
3,5,5-Trimethylhexanoyloxybenzene sulfonate

Synonyms:3,5,5-THBS;3,5,5-trimethylhexanoyloxybenzene sulfonate;3,5,5-trimethylhexanoyloxybenzene sulfonic acid

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Chemical Property of 3,5,5-Trimethylhexanoyloxybenzene sulfonate
Chemical Property:
  • Boiling Point:°Cat760mmHg 
  • Flash Point:°C 
  • PSA：91.88000 
  • Density:1.182g/cm3 
  • LogP:4.32370 
  • XLogP3:3.4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:7
  • Exact Mass:314.11879497
  • Heavy Atom Count:21
  • Complexity:436
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CC(CC(=O)OC1=CC=C(C=C1)S(=O)(=O)O)CC(C)(C)C
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