Substance
  • Substance Name: methyl(trioctyl)ammonium thiosalicylate
  • Formula: C32H59NO2S
  • Molecular Weight: 521.9 g/mol
  • Identifiers:
    • inchi: InChI=1S/C25H54N.C7H6O2S/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3;8-7(9)5-3-1-2-4-6(5)10/h5-25H2,1-4H3;1-4,10H,(H,8,9)/q+1;/p-1
    • inchikey: NJOSLBYBLJVAMY-UHFFFAOYSA-M
    • csmiles: CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.C1=CC=C(C(=C1)C(=O)[O-])S
    • ismiles: CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.C1=CC=C(C(=C1)C(=O)[O-])S
    • pubchemId: 16211126
    • iupacname: methyl(trioctyl)azanium;2-sulfanylbenzoate
    • wikidataId: Q82474939
    • casrn: 1027004-61-0
    • dsstoxcmpId: DTXCID20534135
methyl(trioctyl)ammonium thiosalicylate
Systems and Datasets