2,4-Quinazolinediol

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Properties Simple | Detailed

Formula C8H6N2O2++
IUPAC Name quinazoline-2,4-dione
Molecular Mass 162.145 g·mol−1
Heat of Formation -260.9 ± 16.7 kJ·mol−1
Dipole Moment 4.24 ± 1.08 D
Volume 175.23 Å 3
Surface Area 175.6 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry Cs
Synonyms
  • (1h,3h)-quinazoline-2,4-dione
  • (1h,3h)quinazoline dione-2,4
  • 1,2,3,4-tetrahydroquinazoline-2,4-dione
  • 1h-quinazoline-2,4-dione
  • 1h-quinazoline-2,4-quinone
  • 2,4(1h,3h)-quinazolinedione
  • 2,4-dihydroxyquinazoline
  • 2,4-dioxotetrahydroquinazoline
  • 2-keto-4-quinazolinone
  • 2.4(1h,3h)-quinazolinedione
  • ah-740/03933012
  • benzouracil
  • benzoyleneurea
  • oprea1_764687
  • pdsp1_000044
  • pdsp2_000044
  • quinazoline-2,4-diol
  • quinazolinedione
  • sdccgmls-0065795.p001
  • urea, benzoylene-
CAS Number(s)
  • 86-96-4
InChIKey SDQJTWBNWQABLE-UHFFFAOYSA-N
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