Cas no 71091-89-9 (Methanesulfonic acid, trifluoro-, octyl ester)

Methanesulfonic acid, trifluoro-, octyl ester structure
71091-89-9 structure
Product Name:Methanesulfonic acid, trifluoro-, octyl ester
CAS No:71091-89-9
MF:C9H17F3O3S
MW:262.289692640305
MDL:MFCD29087809
CID:546053
PubChem ID:10869071
Update Time:2025-04-19

Methanesulfonic acid, trifluoro-, octyl ester Chemical and Physical Properties

Names and Identifiers

    • Methanesulfonic acid, trifluoro-, octyl ester
    • octyl trifluoromethanesulfonate
    • 71091-89-9
    • SCHEMBL902041
    • DTXSID80446543
    • AMY27758
    • Octyl triflate
    • trifluoro-methanesulfonic acid octyl ester
    • n-octyl trifluoromethane sulfonate
    • MDL: MFCD29087809
    • Inchi: 1S/C9H17F3O3S/c1-2-3-4-5-6-7-8-15-16(13,14)9(10,11)12/h2-8H2,1H3
    • InChI Key: APYUCYRDBYSFAB-UHFFFAOYSA-N
    • SMILES: S(C(F)(F)F)(=O)(=O)OCCCCCCCC

Computed Properties

  • Exact Mass: 262.08511
  • Monoisotopic Mass: 262.08505006g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 8
  • Complexity: 267
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.3
  • Topological Polar Surface Area: 51.8?2

Experimental Properties

  • PSA: 43.37

Methanesulfonic acid, trifluoro-, octyl ester Pricemore >>

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Methanesulfonic acid, trifluoro-, octyl ester Related Literature

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