(2S)-3-[4-(3-{4-[(2R)-2-Hydroxy-3,3-Dimethylbutoxy]Phenyl}-3-Pentanyl)Phenoxy]-1,2-Propanediol

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Formula C26H38O5
IUPAC Name (2s)-3-[4-[1-ethyl-1-[4-[(2r)-2-hydroxy-3,3-dimethyl-butoxy]phenyl]propyl]phenoxy]propane-1,2-diol
Molecular Mass 430.577 g·mol−1
Heat of Formation -919.7 ± 16.7 kJ·mol−1
Dipole Moment 5.43 ± 1.08 D
Volume 555.91 Å 3
Surface Area 470.14 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.19 ± eV
Point Group Symmetry C1
InChIKey HPEKDMRENBLBLH-URXFXBBRSA-N
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Elements H C O