Aprobarbital

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Properties Simple | Detailed

Formula C10H14N2O3
IUPAC Name 5-allyl-5-isopropyl-hexahydropyrimidine-2,4,6-trione
Molecular Mass 210.230 g·mol−1
Heat of Formation -552.8 ± 16.7 kJ·mol−1
Dipole Moment 2.17 ± 1.08 D
Volume 251.9 Å 3
Surface Area 223.72 Å 2
HOMO Energy -10.46 ± 0.55 eV
LUMO Energy -0.42 ± eV
Point Group Symmetry C1
Synonyms
  • 2,4,6(1h,3h,5h)-pyrimidinetrione, 5-(1-methylethyl)-5-(2-propenyl)-
  • 2,4,6(1h,3h,5h)-pyrimidinetrione, 5-(1-methylethyl)-5-(2-propenyl)- (9ci)
  • 5-(1-methylethyl)-5-(2-propenyl)-2,4,6(1h,3h,5h)-pyrimidinetrione
  • 5-(1-methylethyl)-5-prop-2-en-1-ylpyrimidine-2,4,6(1h,3h,5h)-trione
  • 5-(propan-2-yl)-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1h,3h,5h)-trione
  • 5-allyl-5-isopropyl-barbituric acid
  • 5-allyl-5-isopropylbarbiturate
  • 5-allyl-5-isopropylbarbituric acid
  • 5-allyl-5-isopropylhexahydropyrimidine-2,4,6-trione
  • 5-allyl-5-isopropylpyrimidine-2,4,6(1h,3h,5h)-trione
  • 5-isopropyl-5-allylbarbituric acid
  • 5-propan-2-yl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
  • allional
  • allonal
  • allylisopropylbarbituric acid
  • allylisopropylmalonylurea
  • allylpropymal
  • allypropymal
  • allypropymalum
  • alurate
  • alurate elixir verdum
  • aprobarbita
  • aprobarbital (inn)
  • aprobarbital [dcf:inn]
  • aprobarbitale [dcit]
  • aprobarbitone
  • aprozal
  • barbituric acid, 5-allyl-5-isopropyl-
  • d00698
  • isonal
  • isonal (swedish)
  • isopropylallylbarbituric acid
  • numal
CAS Number(s)
  • 77-02-1
InChIKey UORJNBVJVRLXMQ-UHFFFAOYSA-N
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