Cas no 154381-51-8 (Heptane, 1,1,1,2,2,3,3,4,4-nonafluoro-)

Heptane, 1,1,1,2,2,3,3,4,4-nonafluoro- structure
154381-51-8 structure
Product Name:Heptane, 1,1,1,2,2,3,3,4,4-nonafluoro-
CAS No:154381-51-8
MF:C7H7F9
MW:262.116113901138
CID:1328510
PubChem ID:19091137
Update Time:2025-04-20

Heptane, 1,1,1,2,2,3,3,4,4-nonafluoro- Chemical and Physical Properties

Names and Identifiers

    • Heptane, 1,1,1,2,2,3,3,4,4-nonafluoro-
    • MDZDBKLCYXUTQA-UHFFFAOYSA-N
    • 154381-51-8
    • SCHEMBL6681324
    • DTXSID10895161
    • 1,1,1,2,2,3,3,4,4-nonafluoroheptane
    • NS00109312
    • Inchi: 1S/C7H7F9/c1-2-3-4(8,9)5(10,11)6(12,13)7(14,15)16/h2-3H2,1H3
    • InChI Key: MDZDBKLCYXUTQA-UHFFFAOYSA-N
    • SMILES: FC(CCC)(C(C(C(F)(F)F)(F)F)(F)F)F

Computed Properties

  • Exact Mass: 262.04041
  • Monoisotopic Mass: 262.04040368g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 239
  • 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: 4.6
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
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