Cas no 67584-48-9 (N-allyltridecafluorohexanesulphonamide)

N-allyltridecafluorohexanesulphonamide structure
67584-48-9 structure
Product Name:N-allyltridecafluorohexanesulphonamide
CAS No:67584-48-9
MF:C9H6F13NO2S
MW:439.193686962128
CID:966325
PubChem ID:105437
Update Time:2025-04-19

N-allyltridecafluorohexanesulphonamide Chemical and Physical Properties

Names and Identifiers

    • N-allyltridecafluorohexanesulphonamide
    • 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-N-(prop-2-en-1-yl)hexane-1-sulfonamide
    • 1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluoro-N-2-propenyl-1-hexanesulfonamide
    • 1-Hexanesulfonamide, 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-N-2-propen-1-yl-
    • 1-Hexanesulfonamide, 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-N-2-propenyl-
    • DTXSID2070500
    • OEYYQKXFSDVKJI-UHFFFAOYSA-N
    • 67584-48-9
    • EINECS 266-725-1
    • NS00011245
    • N-Allyltridecafluorohexanesulfonamide
    • Inchi: 1S/C9H6F13NO2S/c1-2-3-23-26(24,25)9(21,22)7(16,17)5(12,13)4(10,11)6(14,15)8(18,19)20/h2,23H,1,3H2
    • InChI Key: OEYYQKXFSDVKJI-UHFFFAOYSA-N
    • SMILES: S(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(NCC=C)(=O)=O

Computed Properties

  • Exact Mass: 438.99118
  • Monoisotopic Mass: 438.991
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 16
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 8
  • Complexity: 631
  • 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: 4.5
  • Topological Polar Surface Area: 54.6?2

Experimental Properties

  • Density: 1.607
  • Boiling Point: 232.5°C at 760 mmHg
  • Flash Point: 94.4°C
  • Refractive Index: 1.341
  • PSA: 46.17
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