Chemical Properties of 5-Ethyl-5-(1-methyl-1,3-butadienyl)-hexahydropyrimidine-2,4,6-trione (CAS 131147-54-1)

5-Ethyl-5-(1-methyl-1,3-butadienyl)-hexahydropyrimidine-2,4,6-trione

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InChI
InChI=1S/C11H14N2O3/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h4,6H,1,5H2,2-3H3,(H2,12,13,14,15,16)/b7-6+
InChI Key
WRVHOVLDFFSSLY-VOTSOKGWSA-N
Formula
C11H14N2O3
SMILES
C=CC=C(C)C1(CC)C(=O)NC(=O)NC1=O
Molecular Weight1
222.24
CAS
131147-54-1
Other Names
  • 5-Ethyl-5-[1-methyl-1,3-butadienyl]-2,4,6(1H,3H,5H)-pyrimidinetrione
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(1-methyl-1,3-butadienyl)-
  • Vinbarbital M (OH, -H2O)
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Physical Properties

Property Value Unit Source
Δf 27.86 kJ/mol Joback Calculated Property
Δfgas -305.43 kJ/mol Joback Calculated Property
Δfus 25.11 kJ/mol Joback Calculated Property
Δvap 64.98 kJ/mol Joback Calculated Property
log10WS -2.47 Crippen Calculated Property
logPoct/wat 0.881 Crippen Calculated Property
McVol 171.060 ml/mol McGowan Calculated Property
Pc 3191.93 kPa Joback Calculated Property
Inp [2020.00; 2020.00]   Show Hide
Inp 2020.00 NIST
Inp 2020.00 NIST
Tboil 772.15 K Joback Calculated Property
Tc 1038.87 K Joback Calculated Property
Tfus 638.93 K Joback Calculated Property
Vc 0.639 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [498.76; 591.50] J/mol×K [772.15; 1038.87] Show Hide
Cp,gas 498.76 J/mol×K 772.15 Joback Calculated Property
Cp,gas 516.29 J/mol×K 816.60 Joback Calculated Property
Cp,gas 532.93 J/mol×K 861.06 Joback Calculated Property
Cp,gas 548.72 J/mol×K 905.51 Joback Calculated Property
Cp,gas 563.72 J/mol×K 949.97 Joback Calculated Property
Cp,gas 577.96 J/mol×K 994.42 Joback Calculated Property
Cp,gas 591.50 J/mol×K 1038.87 Joback Calculated Property

Similar Compounds

Butabarbital M (OH, -H2O). Vinbarbital. Secobarbital M (OH, -H2O). Cyclobarbital M (OH, -H2O). Heptabarbital M (OH, -H2O). Heptabarbital. Cyclobarbital. Hexobarbital M (OH, -H2O). Reposal. Barbituric acid, 5-bicyclo(3.2.1)oct-2-en-3-yl-5-ethyl-. 5-Ethyl-5-(3-oxy-1-cyclohexenyl)-hexahydropyrimidin-2,4,6-trione. Heptabarbital monomethylated. Triamcinolone tetra-TMS. Hexobarbital. 3,5-Dimethyl-5-(3-oxocyclohex-1-enyl)-hexahydropyrimidin-2,4,6-trione.

Find more compounds similar to 5-Ethyl-5-(1-methyl-1,3-butadienyl)-hexahydropyrimidine-2,4,6-trione.

Sources

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