Formula |
C28H42O5 |
IUPAC Name |
(2s)-3-[4-[1-ethyl-1-[4-[(2r)-2-hydroxy-3,3-dimethyl-butoxy]-3-methyl-phenyl]propyl]-2-methyl-phenoxy]propane-1,2-diol |
Molecular Mass |
458.630 g·mol−1 |
Heat of Formation |
-995.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.48 ± 1.08 D |
Volume |
599.74 Å 3 |
Surface Area |
497.58 Å 2 |
HOMO Energy |
-8.56 ± 0.55 eV |
LUMO Energy |
-0.05 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
AIKLCYAFOOBGEV-OZXSUGGESA-N |
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Elements |
H
C
O
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