Formula |
C21H27ClO5 |
IUPAC Name |
(2r)-3-[4-[1-[4-[(2r)-3-chloro-2-hydroxy-propoxy]phenyl]-1-methyl-ethyl]phenoxy]propane-1,2-diol |
Molecular Mass |
394.889 g·mol−1 |
Heat of Formation |
-798.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.33 ± 1.08 D |
Volume |
471.95 Å 3 |
Surface Area |
421.93 Å 2 |
HOMO Energy |
-8.69 ± 0.55 eV |
LUMO Energy |
0.20 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
HDTYUHNZRYZEEB-ZWKOTPCHSA-N |
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Links |
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Elements |
H
C
O
Cl
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