(2E)-1-(5-Hydroxy-7-Methoxy-2,2-Dimethyl-2H-Chromen-6-Yl)-3-(4-Hydroxyphenyl)-2-Propen-1-One

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Properties Simple | Detailed

Formula C21H20O5
IUPAC Name (e)-1-(5-hydroxy-7-methoxy-2,2-dimethyl-chromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Molecular Mass 352.381 g·mol−1
Heat of Formation -649.2 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 412.37 Å 3
Surface Area 364.96 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -0.58 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-1-(5-hydroxy-7-methoxy-2,2-dimethyl-6-chromenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
  • (e)-1-(5-hydroxy-7-methoxy-2,2-dimethyl-chromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
  • (e)-1-(5-hydroxy-7-methoxy-2,2-dimethylchromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
InChIKey CVMUWVCGBFJJFI-RMKNXTFCSA-N
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