(3R,8S,9Z)-1,9-Heptadecadiene-4,6-Diyne-3,8-Diol

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Properties Simple | Detailed

Formula C17H24O2
IUPAC Name (3r,8s,9z)-heptadeca-1,9-dien-4,6-diyne-3,8-diol
Molecular Mass 260.371 g·mol−1
Heat of Formation 37.8 ± 16.7 kJ·mol−1
Dipole Moment 3.15 ± 1.08 D
Volume 367.51 Å 3
Surface Area 316.5 Å 2
HOMO Energy -9.95 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,8s,9z)-heptadeca-1,9-dien-4,6-diyne-3,8-diol
  • 1,9-heptadecadiene-4,6-diyne-3,8-diol, (3r,8s,9z)-
  • falcarindiol
CAS Number(s)
  • 55297-87-5
InChIKey QWCNQXNAFCBLLV-YWALDVPYSA-N
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