Chemical Properties of L-Valine, N-pentafluoropropionyl-, propyl ester

L-Valine, N-pentafluoropropionyl-, propyl ester

InChI
InChI=1S/C11H16F5NO3/c1-4-5-20-8(18)7(6(2)3)17-9(19)10(12,13)11(14,15)16/h6-7H,4-5H2,1-3H3,(H,17,19)
InChI Key
YTVFCNKAGWICST-UHFFFAOYSA-N
Formula
C11H16F5NO3
SMILES
CCCOC(=O)C(NC(=O)C(F)(F)C(F)(F)F)C(C)C
Molecular Weight1
305.24
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Physical Properties

Property Value Unit Source
ΔfusH° 28.84 kJ/mol Joback Calculated Property
logPoct/wat 2.278 Crippen Calculated Property
McVol 193.690 ml/mol McGowan Calculated Property
Pc 1789.39 kPa Joback Calculated Property
Inp [1222.00; 1222.00]   Show Hide
Inp 1222.00 NIST
Inp 1222.00 NIST
Tboil 466.67 K Relay (1.0) Calculated Property
Tc 618.96 K Relay (1.0) Calculated Property
Tfus 314.57 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [309.72; 660.21] 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 A2.59200e+00
Coefficient B1.36466e+00
Coefficient C-9.41900e-04
Coefficient D2.34860e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 309.72 J/mol×K 273.00 Calculated Property
Cp,gas 377.89 J/mol×K 353.78 Calculated Property
Cp,gas 437.02 J/mol×K 434.56 Calculated Property
Cp,gas 487.85 J/mol×K 515.33 Calculated Property
Cp,gas 531.13 J/mol×K 596.11 Calculated Property
Cp,gas 567.60 J/mol×K 676.89 Calculated Property
Cp,gas 597.99 J/mol×K 757.67 Calculated Property
Cp,gas 623.07 J/mol×K 838.44 Calculated Property
Cp,gas 643.56 J/mol×K 919.22 Calculated Property
Cp,gas 660.21 J/mol×K 1000.00 Calculated Property

Similar Compounds

l-Valine, n-pentafluoropropionyl-, ethyl ester. l-Valine, n-pentafluoropropionyl-, isobutyl ester. l-Valine, n-pentafluoropropionyl-, dodecyl ester. L-Valine, N-pentafluoropropionyl-, decyl ester. l-Valine, n-pentafluoropropionyl-, hexadecyl ester. L-Valine, N-pentafluoropropionyl-, pentadecyl ester. L-Valine, N-pentafluoropropionyl-, octyl ester. l-Valine, n-pentafluoropropionyl-, octadecyl ester. l-Valine, n-pentafluoropropionyl-, undecyl ester. l-Valine, n-pentafluoropropionyl-, heptyl ester. l-Valine, n-pentafluoropropionyl-, tetradecyl ester. l-Valine, n-pentafluoropropionyl-, hexyl ester. l-Valine, n-pentafluoropropionyl-, heptadecyl ester. l-Valine, n-pentafluoropropionyl-, nonyl ester. l-Valine, n-heptafluorobutyryl-, propyl ester.

Find more compounds similar to L-Valine, N-pentafluoropropionyl-, propyl ester.

Sources

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