Ethyl {[2-(4-Methylphenyl)-4-Oxo-4H-Chromen-7-Yl]Oxy}Acetate

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Properties Simple | Detailed

Formula C20H18O5
IUPAC Name ethyl 2-[4-oxo-2-(p-tolyl)chromen-7-yl]oxyacetate
Molecular Mass 338.354 g·mol−1
Heat of Formation -611.7 ± 16.7 kJ·mol−1
Dipole Moment 3.01 ± 1.08 D
Volume 390.12 Å 3
Surface Area 368.77 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-keto-2-(4-methylphenyl)chromen-7-yl]oxyacetic acid ethyl ester
  • 2-[[2-(4-methylphenyl)-4-oxo-7-chromenyl]oxy]acetic acid ethyl ester
  • 4'-methylrecordil
  • acetic acid, ((2-(4-methylphenyl)-4-oxo-4h-1-benzopyran-7-yl)oxy)-, ethyl ester
  • ethyl 2-[2-(4-methylphenyl)-4-oxo-chromen-7-yl]oxyacetate
  • ethyl 2-[2-(4-methylphenyl)-4-oxo-chromen-7-yl]oxyethanoate
  • ethyl 2-[2-(4-methylphenyl)-4-oxochromen-7-yl]oxyacetate
CAS Number(s)
  • 78298-71-2
InChIKey NRJYFLATWOKPSV-UHFFFAOYSA-N
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