{[2-(3,4-Dihydroxyphenyl)-3,5-Dihydroxy-4-Oxo-4H-Chromen-7-Yl]Oxy}Methyl Pivalate

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Properties Simple | Detailed

Formula C21H21O9+
IUPAC Name [2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-4-oxo-chromen-7-yl]oxymethyl 2,2-dimethylpropanoate
Molecular Mass 417.386 g·mol−1
Heat of Formation -1371.0 ± 16.7 kJ·mol−1
Dipole Moment 4.84 ± 1.08 D
Volume 457.35 Å 3
Surface Area 411.65 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
InChIKey IVVRHKAPWWQYGY-UHFFFAOYSA-N
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