2-[(2-Hydroxyethoxy)Methyl]-1,2,4-Triazine-3,5(2H,4H)-Dione

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Properties Simple | Detailed

Formula C6H9N3O4++
IUPAC Name 2-(2-hydroxyethoxymethyl)-1,2,4-triazine-3,5-dione
Molecular Mass 187.153 g·mol−1
Heat of Formation -571.6 ± 16.7 kJ·mol−1
Dipole Moment 2.70 ± 1.08 D
Volume 204.83 Å 3
Surface Area 193.12 Å 2
HOMO Energy -10.44 ± 0.55 eV
LUMO Energy 1.95 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2,4-triazine-3,5(2h,4h)-dione, 2-[(2-hydroxyethoxy)methyl]-
  • 1-(2-hydroxyethoxymethyl)-6-azauracil
  • 1-[(2-hydroxyethoxy)methyl]-6-aza uracil
  • 2-(2-hydroxyethoxymethyl)-1,2,4-triazine-3,5-quinone
  • hem-azauracil
CAS Number(s)
  • 96027-42-8
InChIKey IIOXHGRSPAXNEU-UHFFFAOYSA-N
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