Chemical Properties of Glutaric acid, monoamide, N-(2-ethylphenyl)-, isobutyl ester

Glutaric acid, monoamide, N-(2-ethylphenyl)-, isobutyl ester

InChI
InChI=1S/C17H25NO3/c1-4-14-8-5-6-9-15(14)18-16(19)10-7-11-17(20)21-12-13(2)3/h5-6,8-9,13H,4,7,10-12H2,1-3H3,(H,18,19)
InChI Key
BYKFCTOFSUQGEE-UHFFFAOYSA-N
Formula
C17H25NO3
SMILES
CCc1ccccc1NC(=O)CCCC(=O)OCC(C)C
Molecular Weight1
291.39
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Physical Properties

Property Value Unit Source
ΔfH°gas -637.20 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 40.98 kJ/mol Joback Calculated Property
ΔvapH° 92.83 kJ/mol Relay (1.0) Calculated Property
log10WS -3.56 Relay (1.0) Calculated Property
logPoct/wat 3.557 Crippen Calculated Property
McVol 245.620 ml/mol McGowan Calculated Property
Pc 1672.79 kPa Joback Calculated Property
Inp 2670.00 NIST
Tboil 626.23 K Relay (1.0) Calculated Property
Tc 853.17 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [344.54; 809.37] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-2.29500e+00
Coefficient B1.47976e+00
Coefficient C-8.03660e-04
Coefficient D1.35560e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 344.54 J/mol×K 273.00 Calculated Property
Cp,gas 426.63 J/mol×K 353.78 Calculated Property
Cp,gas 500.11 J/mol×K 434.56 Calculated Property
Cp,gas 565.40 J/mol×K 515.33 Calculated Property
Cp,gas 622.94 J/mol×K 596.11 Calculated Property
Cp,gas 673.16 J/mol×K 676.89 Calculated Property
Cp,gas 716.48 J/mol×K 757.67 Calculated Property
Cp,gas 753.34 J/mol×K 838.44 Calculated Property
Cp,gas 784.16 J/mol×K 919.22 Calculated Property
Cp,gas 809.37 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, monoamide, N-(2-ethylphenyl)-, propyl ester. Glutaric acid, monoamide, N-(2-ethylphenyl)-, butyl ester. Glutaric acid, monoamide, N-(2-ethylphenyl)-, pentyl ester. Glutaric acid, monoamide, N-(2-ethylphenyl)-, nonyl ester. Glutaric acid, monoamide, N-(2-ethylphenyl)-, hexyl ester. Glutaric acid, monoamide, N-(2-ethylphenyl)-, octyl ester. Glutaric acid, monoamide, N-(2-ethylphenyl)-, ethyl ester. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-ethylhexyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, isobutyl ester. Glutaric acid, diamide, N,N'-di(2-ethylphenyl)-. Carteolol, PFB-TMS. Carteolol, acetylated. Lycoramine. Acebutolol, N-ethoxycarbonylated, TMS. Fumaric acid, monoamide, N-(2-ethylphenyl)-, 2-pentyl ester.

Find more compounds similar to Glutaric acid, monoamide, N-(2-ethylphenyl)-, isobutyl ester.

Sources

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