Chemical Properties of l-Isoleucine, n-heptafluorobutyryl-, ethyl ester

l-Isoleucine, n-heptafluorobutyryl-, ethyl ester

InChI
InChI=1S/C12H16F7NO3/c1-4-6(3)7(8(21)23-5-2)20-9(22)10(13,14)11(15,16)12(17,18)19/h6-7H,4-5H2,1-3H3,(H,20,22)
InChI Key
FXOBMWXZJDHCEN-UHFFFAOYSA-N
Formula
C12H16F7NO3
SMILES
CCOC(=O)C(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)C(C)CC
Molecular Weight1
355.25
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Physical Properties

Property Value Unit Source
ω 0.6213 Relay (1.0) Calculated Property
ΔfusH° 30.18 kJ/mol Joback Calculated Property
ΔvapH° 72.12 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.913 Crippen Calculated Property
McVol 211.320 ml/mol McGowan Calculated Property
Pc 1561.05 kPa Joback Calculated Property
Inp [1250.00; 1250.00]   Show Hide
Inp 1250.00 NIST
Inp 1250.00 NIST
Tboil 478.78 K Relay (1.0) Calculated Property
Tc 627.05 K Relay (1.0) Calculated Property
Tfus 292.04 K Relay (1.0) Calculated Property
Vc 0.760 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, 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 [604.37; 671.50] J/mol×K [620.74; 783.36] Show Hide
Cp,gas 604.37 J/mol×K 620.74 Joback Calculated Property
Cp,gas 617.48 J/mol×K 647.84 Joback Calculated Property
Cp,gas 629.77 J/mol×K 674.95 Joback Calculated Property
Cp,gas 641.28 J/mol×K 702.05 Joback Calculated Property
Cp,gas 652.04 J/mol×K 729.15 Joback Calculated Property
Cp,gas 662.10 J/mol×K 756.26 Joback Calculated Property
Cp,gas 671.50 J/mol×K 783.36 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to l-Isoleucine, n-heptafluorobutyryl-, ethyl ester.

Sources

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