Chemical Properties of l-Isoleucine, n-pentafluoropropionyl-, isobutyl ester

l-Isoleucine, n-pentafluoropropionyl-, isobutyl ester

InChI
InChI=1S/C13H20F5NO3/c1-5-8(4)9(10(20)22-6-7(2)3)19-11(21)12(14,15)13(16,17)18/h7-9H,5-6H2,1-4H3,(H,19,21)
InChI Key
ASHLEKATHZTOSX-UHFFFAOYSA-N
Formula
C13H20F5NO3
SMILES
CCC(C)C(NC(=O)C(F)(F)C(F)(F)F)C(=O)OCC(C)C
Molecular Weight1
333.29
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Physical Properties

Property Value Unit Source
ΔfH°gas -1817.37 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 30.50 kJ/mol Joback Calculated Property
ΔvapH° 69.52 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.914 Crippen Calculated Property
McVol 221.870 ml/mol McGowan Calculated Property
Pc 1540.29 kPa Joback Calculated Property
Inp [1344.00; 1344.00]   Show Hide
Inp 1344.00 NIST
Inp 1344.00 NIST
Tboil 492.02 K Relay (1.0) Calculated Property
Tc 640.80 K Relay (1.0) Calculated Property
Tfus 307.32 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [637.99; 711.43] J/mol×K [647.87; 817.08] Show Hide
Cp,gas 637.99 J/mol×K 647.87 Joback Calculated Property
Cp,gas 652.22 J/mol×K 676.07 Joback Calculated Property
Cp,gas 665.61 J/mol×K 704.27 Joback Calculated Property
Cp,gas 678.19 J/mol×K 732.48 Joback Calculated Property
Cp,gas 690.00 J/mol×K 760.68 Joback Calculated Property
Cp,gas 701.07 J/mol×K 788.88 Joback Calculated Property
Cp,gas 711.43 J/mol×K 817.08 Joback Calculated Property

Similar Compounds

l-Isoleucine, n-pentafluoropropionyl-, propyl ester. l-Isoleucine, n-pentafluoropropionyl-, pentyl ester. L-isoleucine, n-pentafluoropropionyl-, ethyl ester. L-isoleucine, n-pentafluoropropionyl-, pentadecyl ester. l-Isoleucine, n-pentafluoropropionyl-, hexyl ester. l-Isoleucine, n-pentafluoropropionyl-, hexadecyl ester. l-Isoleucine, n-pentafluoropropionyl-, undecyl ester. L-Isoleucine, N-pentafluoropropionyl-, heptadecyl ester. l-Isoleucine, n-pentafluoropropionyl-, tetradecyl ester. L-Isoleucine, N-pentafluoropropionyl-, heptyl ester. L-isoleucine, n-pentafluoropropionyl-, octyl ester. l-Isoleucine, n-pentafluoropropionyl-, decyl ester. l-Isoleucine, n-pentafluoropropionyl-, octadecyl ester. l-Isoleucine, n-heptafluorobutyryl-, propyl ester. l-Isoleucine, n-heptafluorobutyryl-, ethyl ester.

Find more compounds similar to l-Isoleucine, n-pentafluoropropionyl-, isobutyl ester.

Sources

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