Chemical Properties of .beta.-Alanine, N-(3-fluorobenzoyl)-, tetradecyl ester

.beta.-Alanine, N-(3-fluorobenzoyl)-, tetradecyl ester

InChI
InChI=1S/C24H38FNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-29-23(27)17-18-26-24(28)21-15-14-16-22(25)20-21/h14-16,20H,2-13,17-19H2,1H3,(H,26,28)
InChI Key
WNWVUBZNOTUDFO-UHFFFAOYSA-N
Formula
C24H38FNO3
SMILES
CCCCCCCCCCCCCCOC(=O)CCNC(=O)c1cccc(F)c1
Molecular Weight1
407.57
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Physical Properties

Property Value Unit Source
ΔfusH° 65.72 kJ/mol Joback Calculated Property
ΔvapH° 129.56 kJ/mol Relay (1.0) Calculated Property
log10WS -6.85 Relay (1.0) Calculated Property
logPoct/wat 6.190 Crippen Calculated Property
McVol 346.020 ml/mol McGowan Calculated Property
Pc 995.13 kPa Joback Calculated Property
Inp 3245.00 NIST
Tboil 679.01 K Relay (1.0) Calculated Property
Tfus 320.88 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, 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 [501.55; 1177.04] 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-8.85000e-01
Coefficient B2.15062e+00
Coefficient C-1.19766e-03
Coefficient D2.24960e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 501.55 J/mol×K 273.00 Calculated Property
Cp,gas 620.02 J/mol×K 353.78 Calculated Property
Cp,gas 725.97 J/mol×K 434.56 Calculated Property
Cp,gas 820.13 J/mol×K 515.33 Calculated Property
Cp,gas 903.19 J/mol×K 596.11 Calculated Property
Cp,gas 975.87 J/mol×K 676.89 Calculated Property
Cp,gas 1038.89 J/mol×K 757.67 Calculated Property
Cp,gas 1092.94 J/mol×K 838.44 Calculated Property
Cp,gas 1138.76 J/mol×K 919.22 Calculated Property
Cp,gas 1177.03 J/mol×K 1000.00 Calculated Property

Similar Compounds

«beta»-Alanine, N-(3-fluorobenzoyl)-, nonyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, undecyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, pentadecyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, octyl ester. .beta.-Alanine, N-(3-fluorobenzoyl)-, heptyl ester. .beta.-Alanine, N-(3-fluorobenzoyl)-, decyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, hexyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, pentyl ester. «beta»-Alanine, N-(3-fluorobenzoyl)-, butyl ester. .BETA.-alanine, n-(4-fluorobenzoyl)-, octyl ester. .beta.-Alanine, N-(4-fluorobenzoyl)-, heptyl ester. «beta»-Alanine, N-(4-fluorobenzoyl)-, nonyl ester. «beta»-Alanine, N-(4-fluorobenzoyl)-, undecyl ester. «beta»-Alanine, N-(4-fluorobenzoyl)-, decyl ester. «beta»-Alanine, N-(4-fluorobenzoyl)-, dodecyl ester.

Find more compounds similar to .beta.-Alanine, N-(3-fluorobenzoyl)-, tetradecyl ester.

Sources

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