[3-(Hexopyranosyloxy)-6-Hydroxy-8-Methyl-9,10-Dioxatetracyclo[4.3.1.0~2,5~.0~3,8~]Dec-2-Yl]Methyl Benzoate

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Properties Simple | Detailed

Formula C23H28O11
IUPAC Name formaldehyde; 2-[3-(2-hydroxyethynyl)-1',3'-dioxo-spiro[cyclopropane-2,2'-indane]-1-yl]oxy-6-(oxomethylene)tetrahydropyran-3,4,5-trione; prop-1-yn-1-ol
Molecular Mass 480.462 g·mol−1
Heat of Formation 1326.8 ± 16.7 kJ·mol−1
Dipole Moment 5.83 ± 1.08 D
Volume 474.88 Å 3
Surface Area 369.34 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.85 ± eV
Point Group Symmetry C1
InChIKey YKRGDOXKVOZESV-FYESNDNDSA-N
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