1-{[6-(4-Fluorophenoxy)-2H-Chromen-3-Yl]Methyl}-1-Hydroxy-3-Methylurea

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Properties Simple | Detailed

Formula C18H17FN2O4
IUPAC Name 1-[[6-(4-fluorophenoxy)-2h-chromen-3-yl]methyl]-1-hydroxy-3-methyl-urea
Molecular Mass 344.337 g·mol−1
Heat of Formation -498.7 ± 16.7 kJ·mol−1
Dipole Moment 1.78 ± 1.08 D
Volume 392.68 Å 3
Surface Area 345.22 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[[6-(4-fluorophenoxy)-2h-chromen-3-yl]methyl]-1-hydroxy-3-methyl-urea
  • 1-[[6-(4-fluorophenoxy)-2h-chromen-3-yl]methyl]-1-hydroxy-3-methylurea
  • 3-((n-((n'-methylamino)carbonyl)-n-hydroxyamino)methyl)-6-(4'-fluorophenoxy)chromene
  • cgs 24891
  • cgs-24891
  • macha-fphoc
  • urea, n-((6-(4-fluorophenoxy)-2h-1-benzopyran-3-yl)methyl)-n-hydroxy-n'-methyl-
CAS Number(s)
  • 134823-10-2
InChIKey SOEOWQASEQWFFZ-UHFFFAOYSA-N
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