3-Hydroxy-Quinazoline-2,4-Dione

Molecule SVG Image

Properties Simple | Detailed

Formula C8H6N2O3++
IUPAC Name 3-hydroxyquinazoline-2,4-dione
Molecular Mass 178.145 g·mol−1
Heat of Formation -262.9 ± 16.7 kJ·mol−1
Dipole Moment 4.41 ± 1.08 D
Volume 186.77 Å 3
Surface Area 185.66 Å 2
HOMO Energy -9.60 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
Synonyms
  • 3-hydroxy-1h-quinazoline-2,4-dione
  • 3-hydroxy-1h-quinazoline-2,4-quinone
  • 3-hydroxy-2,4(1h,3h)-quinazolinedione
CAS Number(s)
  • 5329-43-1
InChIKey TZZSQUATPYDROZ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N