(2S)-5,7-Dihydroxy-2-(4-Hydroxyphenyl)-6-(2-Methyl-3-Buten-2-Yl)-2,3-Dihydro-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C20H20O5
IUPAC Name (2s)-6-(1,1-dimethylallyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one
Molecular Mass 340.370 g·mol−1
Heat of Formation -718.2 ± 16.7 kJ·mol−1
Dipole Moment 3.47 ± 1.08 D
Volume 393.55 Å 3
Surface Area 335.82 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-(2-methylbut-3-en-2-yl)chroman-4-one
  • (2s)-6-(1,1-dimethylprop-2-enyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-chromanone
  • (2s)-6-(1,1-dimethylprop-2-enyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one
InChIKey GKOWEQNADRJYIA-HNNXBMFYSA-N
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