Formula |
C20H16O9 |
IUPAC Name |
methyl 2-(6,8-dihydroxy-3-methyl-1-oxo-isochromene-7-carbonyl)-3-hydroxy-5-methoxy-benzoate |
Molecular Mass |
400.336 g·mol−1 |
Heat of Formation |
-1377.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.89 ± 1.08 D |
Volume |
420.59 Å 3 |
Surface Area |
357.74 Å 2 |
HOMO Energy |
-9.28 ± 0.55 eV |
LUMO Energy |
-1.17 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2-(6,8-dihydroxy-1-keto-3-methyl-isochromene-7-carbonyl)-3-hydroxy-5-methoxy-benzoic acid methyl ester
- 2-[(6,8-dihydroxy-3-methyl-1-oxo-7-isochromenyl)-oxomethyl]-3-hydroxy-5-methoxybenzoic acid methyl ester
- methyl 2-(6,8-dihydroxy-3-methyl-1-oxo-isochromen-7-yl)carbonyl-3-hydroxy-5-methoxy-benzoate
- methyl 2-(6,8-dihydroxy-3-methyl-1-oxoisochromene-7-carbonyl)-3-hydroxy-5-methoxybenzoate
|
InChIKey |
MYFOFPHZNZXXJC-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
|
|
|