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Panaxydol | 72800-72-7

Product name:Panaxydol

CAS No:72800-72-7
MF:C17H24O2
MW:260.3713
CID:567619
PubChem ID:126312
Names and Identifiers
  • 1-Octene-4,6-diyn-3-ol,8-[(2R,3S)-3-heptyl-2-oxiranyl]-, (3R)-
  • (3R,9R,10S)-panaxydol
  • Panaxydol
  • PANAXYDOL(AS)
  • (-)-Panaxydol
  • (3R,9R,10S)-9,10-Epoxy-1-heptadecene-4,6-diyn-3-ol
  • 9,10-epoxy-1-heptadecen-4,6-diyn-3-ol
  • 1-Octene-4,6-diyn-3-ol, 8-(3-heptyloxiranyl)-
  • GVLDSGIQZAFIAN-UHFFFAOYSA-N
  • LMFA05000028
  • 9,10-Epoxy-1-heptadecene-4,6-diyn-3-ol
  • 9,10-epoxy-heptadeca-1-en-4,6-diyn-3-ol
  • 8-(3-Heptyloxiranyl)-1-Octene-4,6-diyn-3-ol
  • 8-(3-heptyloxiran-2-yl)oct-1-en-4,6-diyn-3-ol
  • 8-(3-Heptyloxiranyl)-1-octene-4,6-diyn-3-ol, 9CI
  • CS-0016902
  • DTXSID40993604
  • AKOS040760615
  • P3VHC8ZL8G
  • HY-N1456
  • Q27135345
  • (3R, 9R, 10S)-panaxydol
  • 8-(3-Heptyloxiran-2-yl)oct-1-ene-4,6-diyn-3-ol
  • CHEBI:66723
  • (3r)-8-[(2r,3s)-3-heptyloxiran-2-yl]oct-1-ene-4,6-diyn-3-ol
  • Panaxydol, (-)-
  • 1-Octene-4,6-diyn-3-ol, 8-[(2R,3S)-3-heptyl-2-oxiranyl]-, (3R)-
  • (3R)-8-[(2R,3S)-3-heptyloxiran-2-yl]oct-1-en-4,6-diyn-3-ol
  • (3R)-8-[(2R,3S)-3-Heptyl-2-oxiranyl]-1-octene-4,6-diyn-3-ol
  • 1-Octene-4,6-diyn-3-ol, 8-[(2R,3S)-3-heptyloxiranyl]-, (3R)-
  • 72800-72-7
  • 1-Octene-4,6-diyn-3-ol, 8-(3-heptyloxiranyl)-, [2R-[2alpha(R*),3alpha]]-
  • MDL:MFCD28964215
  • InChIKey:GVLDSGIQZAFIAN-UHFFFAOYSA-N
  • Inchi:1S/C17H24O2/c1-3-5-6-7-10-13-16-17(19-16)14-11-8-9-12-15(18)4-2/h4,15-18H,2-3,5-7,10,13-14H2,1H3
  • SMILES:O1C([H])(C([H])([H])C#CC#CC([H])(C([H])=C([H])[H])O[H])C1([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 260.4g/mol
  • Surface Charge: 0
  • XLogP3: 4.5
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Rotatable Bond Count: 9
  • Monoisotopic Mass: 260.17763g/mol
  • Monoisotopic Mass: 260.17763g/mol
  • Topological Polar Surface Area: 32.8Ų
  • Heavy Atom Count: 19
  • Complexity: 398
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Covalently-Bonded Unit Count: 1

Experimental Properties

  • LogP: 3.05810
  • PSA: 32.76000
  • Refractive Index: 1.507
  • Boiling Point: 397.8°C at 760 mmHg
  • Flash Point: 167.5°C
  • Solubility: Insuluble (2.0E-3 g/L) (25 ºC),
  • Color/Form: Oil
  • Density: 0.999±0.06 g/cm3 (20 ºC 760 Torr),
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