3-(Hydroxymethyl)-2,5,9-Trimethyl-7H-Furo[3,2-G]Chromen-7-One

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Properties Simple | Detailed

Formula C15H15O4+
IUPAC Name 3-(hydroxymethyl)-2,5,9-trimethyl-furo[3,2-g]chromen-7-one
Molecular Mass 259.277 g·mol−1
Heat of Formation -519.7 ± 16.7 kJ·mol−1
Dipole Moment 7.11 ± 1.08 D
Volume 297.6 Å 3
Surface Area 275.42 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • 2,5,9-trimethyl-3-methylol-furo[4,5-g]chromen-7-one
  • 3-(hydroxymethyl)-2,5,9-trimethyl-7-furo[3,2-g]chromenone
  • 3-(hydroxymethyl)-2,5,9-trimethyl-7h-furo(3,2-g)(1)benzopyran-7-one
  • 3-(hydroxymethyl)-2,5,9-trimethylfuro[3,2-g]chromen-7-one
  • 4'-(hydroxymethyl)-4,5',8-trimethylpsoralen
  • 4'-hydroxymethyl-4,5',8-trimethylpsoralen
  • 7h-furo(3,2-g)(1)benzopyran-7-one, 3-(hydroxymethyl)-2,5,9-trimethyl-
  • 7h-furo[3,2-g][1]benzopyran-7-one, 3-(hydroxymethyl)-2,5,9-trimethyl-
  • hydroxymethyltrioxsalen
  • pso
CAS Number(s)
  • 62442-59-5
InChIKey RGJSDHXSAKMPNM-UHFFFAOYSA-N
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