Cas no 59014-54-9 (Cyclopropaneethanol, 2-octadecyl-, cis-)

Cyclopropaneethanol, 2-octadecyl-, cis- structure
59014-54-9 structure
Product Name:Cyclopropaneethanol, 2-octadecyl-, cis-
CAS No:59014-54-9
MF:C23H46O
MW:338.610747814178
CID:340182
PubChem ID:71443235
Update Time:2025-04-19

Cyclopropaneethanol, 2-octadecyl-, cis- Chemical and Physical Properties

Names and Identifiers

    • Cyclopropaneethanol, 2-octadecyl-, cis-
    • 2-[(1S,2S)-2-octadecylcyclopropyl]ethanol
    • 59014-54-9
    • DTXSID00852066
    • 2-[(1S,2S)-2-Octadecylcyclopropyl]ethan-1-ol
    • Inchi: 1S/C23H46O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-21-23(22)19-20-24/h22-24H,2-21H2,1H3/t22-,23+/m0/s1
    • InChI Key: KWHBXOZFJPHJJP-XZOQPEGZSA-N
    • SMILES: OCC[C@@H]1C[C@@H]1CCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 338.35508
  • Monoisotopic Mass: 338.354866087g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 19
  • Complexity: 250
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 10.5
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23
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