Cas no 57475-95-3 (HEPTADECANOIC ACID, TRITRIACONTAFLUORO-)

HEPTADECANOIC ACID, TRITRIACONTAFLUORO- structure
57475-95-3 structure
Product Name:HEPTADECANOIC ACID, TRITRIACONTAFLUORO-
CAS No:57475-95-3
MF:C17HF33O2
MW:864.135961294174
CID:3441652
PubChem ID:12731199
Update Time:2025-04-21

HEPTADECANOIC ACID, TRITRIACONTAFLUORO- Chemical and Physical Properties

Names and Identifiers

    • HEPTADECANOIC ACID, TRITRIACONTAFLUORO-
    • Heptadecanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,17-tritriacontafluoro-
    • ZAWWKRYRIHWWDN-UHFFFAOYSA-N
    • perfluoroheptadecanoic acid
    • SCHEMBL3369703
    • 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,17-Tritriacontafluoroheptadecanoic acid
    • PERFLUOROHEPTADECANOATE
    • 57475-95-3
    • NS00011262
    • DTXSID60896623
    • DTXCID301326115
    • PFHpDA
    • Inchi: 1S/C17HF33O2/c18-2(19,1(51)52)3(20,21)4(22,23)5(24,25)6(26,27)7(28,29)8(30,31)9(32,33)10(34,35)11(36,37)12(38,39)13(40,41)14(42,43)15(44,45)16(46,47)17(48,49)50/h(H,51,52)
    • InChI Key: ZAWWKRYRIHWWDN-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

Computed Properties

  • Exact Mass: 863.9449586Da
  • Monoisotopic Mass: 863.9449586Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 35
  • Heavy Atom Count: 52
  • Rotatable Bond Count: 15
  • Complexity: 1350
  • 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: 11
  • Topological Polar Surface Area: 37.3?2
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