Formula |
C20H16O10 |
IUPAC Name |
(2-hydroxy-5-methoxy-3-methoxycarbonyl-phenyl) 6,8-dihydroxy-3-methyl-1-oxo-isochromene-7-carboxylate |
Molecular Mass |
416.335 g·mol−1 |
Heat of Formation |
-1501.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.65 ± 1.08 D |
Volume |
438.8 Å 3 |
Surface Area |
394.34 Å 2 |
HOMO Energy |
-8.97 ± 0.55 eV |
LUMO Energy |
-1.11 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2-hydroxy-5-methoxy-3-methoxycarbonylphenyl) 6,8-dihydroxy-3-methyl-1-oxoisochromene-7-carboxylate
- 6,8-dihydroxy-1-keto-3-methyl-isochromene-7-carboxylic acid (3-carbomethoxy-2-hydroxy-5-methoxy-phenyl) ester
- 6,8-dihydroxy-3-methyl-1-oxo-7-isochromenecarboxylic acid (2-hydroxy-5-methoxy-3-methoxycarbonylphenyl) ester
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InChIKey |
RFIFNISZAQAYIG-UHFFFAOYSA-N |
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Links |
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Elements |
H
C
O
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