(3R)-8-[(2R,3S)-3-Heptyl-2-Oxiranyl]-1-Octene-4,6-Diyn-3-Ol

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Properties Simple | Detailed

Formula C17H24O2
IUPAC Name (3r)-8-[(2r,3s)-3-heptyloxiran-2-yl]oct-1-en-4,6-diyn-3-ol
Molecular Mass 260.371 g·mol−1
Heat of Formation 105.6 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 357.04 Å 3
Surface Area 347.1 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-8-[(2r,3s)-3-heptyl-2-oxiranyl]oct-1-en-4,6-diyn-3-ol
  • (3r)-8-[(2r,3s)-3-heptyloxiran-2-yl]oct-1-en-4,6-diyn-3-ol
  • 1-octene-4,6-diyn-3-ol, 8-(3-heptyloxiranyl)-
CAS Number(s)
  • 72800-72-7
InChIKey GVLDSGIQZAFIAN-IXDOHACOSA-N
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