(5Z)-7-{(1S,2R,3R,5S)-3-[(1E,3S)-3-Hydroxy-1-Octen-1-Yl]-6-Oxabicyclo[3.1.1]Hept-2-Yl}-5-Heptenoic Acid

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Properties Simple | Detailed

Formula C21H34O4
IUPAC Name (z)-7-[(1s,3r,4r,5s)-3-[(e,3s)-3-hydroxyoct-1-enyl]-6-oxabicyclo[3.1.1]heptan-4-yl]hept-5-enoic acid
Molecular Mass 350.492 g·mol−1
Heat of Formation -790.3 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 473.93 Å 3
Surface Area 360.39 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 3.71 ± eV
Point Group Symmetry C1
InChIKey HAJUMEFPOWPAQL-IGUVKOCZSA-N
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Elements H C O