Chemical Properties of L-Valine, N-(4-fluorobenzoyl)-, pentyl ester

L-Valine, N-(4-fluorobenzoyl)-, pentyl ester

InChI
InChI=1S/C17H24FNO3/c1-4-5-6-11-22-17(21)15(12(2)3)19-16(20)13-7-9-14(18)10-8-13/h7-10,12,15H,4-6,11H2,1-3H3,(H,19,20)
InChI Key
HUFGZGSFZHYOJX-UHFFFAOYSA-N
Formula
C17H24FNO3
SMILES
CCCCCOC(=O)C(NC(=O)c1ccc(F)cc1)C(C)C
Molecular Weight1
309.38
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 40.54 kJ/mol Joback Calculated Property
log10WS -4.64 Relay (1.0) Calculated Property
logPoct/wat 3.313 Crippen Calculated Property
McVol 247.390 ml/mol McGowan Calculated Property
Pc 1623.29 kPa Joback Calculated Property
Inp [2142.00; 2142.00]   Show Hide
Inp 2142.00 NIST
Inp 2142.00 NIST
Tboil 604.43 K Relay (1.0) Calculated Property
Tfus 346.10 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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 [352.43; 816.97] 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 A2.11400e+00
Coefficient B1.49746e+00
Coefficient C-8.23260e-04
Coefficient D1.40660e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 352.43 J/mol×K 273.00 Calculated Property
Cp,gas 435.07 J/mol×K 353.78 Calculated Property
Cp,gas 508.92 J/mol×K 434.56 Calculated Property
Cp,gas 574.42 J/mol×K 515.33 Calculated Property
Cp,gas 632.02 J/mol×K 596.11 Calculated Property
Cp,gas 682.15 J/mol×K 676.89 Calculated Property
Cp,gas 725.27 J/mol×K 757.67 Calculated Property
Cp,gas 761.82 J/mol×K 838.44 Calculated Property
Cp,gas 792.24 J/mol×K 919.22 Calculated Property
Cp,gas 816.97 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Valine, N-(4-fluorobenzoyl)-, octyl ester. L-Valine, N-(4-fluorobenzoyl)-, heptadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, octadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, dodecyl ester. L-Valine, N-(4-fluorobenzoyl)-, tetradecyl ester. L-Valine, N-(4-fluorobenzoyl)-, heptyl ester. L-Valine, N-(4-fluorobenzoyl)-, hexyl ester. L-Valine, N-(4-fluorobenzoyl)-, pentadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, decyl ester. L-Valine, N-(4-fluorobenzoyl)-, undecyl ester. L-Valine, N-(4-fluorobenzoyl)-, hexadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, nonyl ester. L-Valine, N-(4-fluorobenzoyl)-, butyl ester. L-Valine, N-(4-fluorobenzoyl)-, propyl ester. L-Valine, N-(3,4-difluorobenzoyl)-, pentyl ester.

Find more compounds similar to L-Valine, N-(4-fluorobenzoyl)-, pentyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.