Chemical Properties of 5-Ethyl-5-pentylbarbituric acid

5-Ethyl-5-pentylbarbituric acid

InChI
InChI=1S/C11H18N2O3/c1-3-5-6-7-11(4-2)8(14)12-10(16)13-9(11)15/h3-7H2,1-2H3,(H2,12,13,14,15,16)
InChI Key
XYGXSCVUMIDZRR-UHFFFAOYSA-N
Formula
C11H18N2O3
SMILES
CCCCCC1(CC)C(=O)NC(=O)NC1=O
Molecular Weight1
226.28
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Physical Properties

Property Value Unit Source
ω 0.6800 Relay (1.0) Calculated Property
ΔfG° -131.65 kJ/mol Joback Calculated Property
ΔfH°gas -644.60 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 27.49 kJ/mol Joback Calculated Property
ΔvapH° 91.20 kJ/mol Relay (1.0) Calculated Property
IE 9.53 eV Relay (1.0) Calculated Property
log10WS -2.34 Rytting (2005)
logPoct/wat 1.329 Crippen Calculated Property
McVol 179.660 ml/mol McGowan Calculated Property
Pc 2862.74 kPa Joback Calculated Property
Tboil 578.57 K Relay (1.0) Calculated Property
Tc 830.91 K Relay (1.0) Calculated Property
Tfus 429.64 K Relay (1.0) Calculated Property
Vc 0.626 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [549.70; 645.20] J/mol×K [771.43; 1018.96] Show Hide
Cp,gas 549.70 J/mol×K 771.43 Joback Calculated Property
Cp,gas 567.97 J/mol×K 812.69 Joback Calculated Property
Cp,gas 585.29 J/mol×K 853.94 Joback Calculated Property
Cp,gas 601.66 J/mol×K 895.20 Joback Calculated Property
Cp,gas 617.09 J/mol×K 936.45 Joback Calculated Property
Cp,gas 631.61 J/mol×K 977.71 Joback Calculated Property
Cp,gas 645.20 J/mol×K 1018.96 Joback Calculated Property

Similar Compounds

Hexethal. 5-ethyl-5-octyl-1,3-diazinane-2,4,6-trione. 5-Nonyl-5-ethylbarbituric acid. 5-ethyl-5-heptyl-1,3-diazinane-2,4,6-trione. Butethal. Spiro[cyclooctane-1,5'(6'H)-pyrimidine]-2',4',6'(1'H,3'H)-trione. Cycloheptyl-5-spirobarbituric acid. 2,4-diazaspiro[5.5]undecane-1,3,5-trione. Barbituric acid, 5,5-dipropyl-. Amobarbital. 7,9-diazaspiro[4.5]decane-6,8,10-trione. Barbituric acid, 5-propyl-5-(2-methylpropyl). 5-methyl-5-propyl-1,3-diazinane-2,4,6-trione. Pentobarbital. 5-Acetonyl-5-propyl-hexahydropyrimidin-2,4,6-trione.

Find more compounds similar to 5-Ethyl-5-pentylbarbituric acid.

Sources

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