2-[3-(2,3-Dihydroxy-3-Methylbutoxy)-2-Hydroxy-5-Methylbenzoyl]-6-Hydroxy-3-(3-Methyl-2-Buten-1-Yl)Benzaldehyde

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Properties Simple | Detailed

Formula C25H30O7
IUPAC Name 2-[3-[(2s)-2,3-dihydroxy-3-methyl-butoxy]-2-hydroxy-5-methyl-benzoyl]-6-hydroxy-3-(3-methylbut-2-enyl)benzaldehyde
Molecular Mass 442.502 g·mol−1
Heat of Formation -1172.4 ± 16.7 kJ·mol−1
Dipole Moment 8.44 ± 1.08 D
Volume 536.16 Å 3
Surface Area 411.68 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
InChIKey AXMCRMUBMNEKLN-OAQYLSRUSA-N
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Elements H C O