Chemical Properties of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(2-propenyl)- (CAS 2373-84-4)

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(2-propenyl)-

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InChI
InChI=1S/C9H12N2O3/c1-3-5-9(4-2)6(12)10-8(14)11-7(9)13/h3H,1,4-5H2,2H3,(H2,10,11,12,13,14)
InChI Key
QPADNTZLUBYNEN-UHFFFAOYSA-N
Formula
C9H12N2O3
SMILES
C=CCC1(CC)C(=O)NC(=O)NC1=O
Molecular Weight1
196.20
CAS
2373-84-4
Other Names
  • 5-Allyl-5-ethylbarbituric acid
  • 5-allyl-5-ethylbarbital
  • Aethallymal
  • Barbituric acid, 5-allyl-5-ethyl-
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Physical Properties

Property Value Unit Source
Δf -60.65 kJ/mol Joback Calculated Property
Δfgas -371.58 kJ/mol Joback Calculated Property
Δfus 21.03 kJ/mol Joback Calculated Property
Δvap 60.49 kJ/mol Joback Calculated Property
log10WS [-1.61; -1.61]   Show Hide
log10WS -1.61 Aq. Sol...
log10WS -1.61 Estimat...
log10WS -1.61 Rytting...
logPoct/wat 0.325 Crippen Calculated Property
McVol 147.180 ml/mol McGowan Calculated Property
Pc 3740.80 kPa Joback Calculated Property
Inp [1532.00; 1555.00]   Show Hide
Inp 1532.00 NIST
Inp 1555.00 NIST
Inp 1555.00 NIST
Tboil 722.35 K Joback Calculated Property
Tc 986.65 K Joback Calculated Property
Tfus 635.43 K Joback Calculated Property
Vc 0.546 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [416.24; 503.71] J/mol×K [722.35; 986.65] Show Hide
Cp,gas 416.24 J/mol×K 722.35 Joback Calculated Property
Cp,gas 432.85 J/mol×K 766.40 Joback Calculated Property
Cp,gas 448.64 J/mol×K 810.45 Joback Calculated Property
Cp,gas 463.61 J/mol×K 854.50 Joback Calculated Property
Cp,gas 477.77 J/mol×K 898.55 Joback Calculated Property
Cp,gas 491.14 J/mol×K 942.60 Joback Calculated Property
Cp,gas 503.71 J/mol×K 986.65 Joback Calculated Property

Similar Compounds

Allobarbital. Crotarbital. Aprobarbital. 5-allyl-5-methyl-barbituric acid. Brallobarbital. Amobarbital M (OH, -H2O). 5-Allyl-5-butylbarbituric acid. Barbituric acid, 5-allyl-5-neopentyl-. Butalbital. Talbutal. Brallobarbital M (des-Br, OH). 5-(3-Methyl-2-butenyl)-5-isoPrbarbital. Secobarbital. Propallylonal. Barbital.

Find more compounds similar to 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(2-propenyl)-.

Sources

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