Chemical Properties of L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, isohexyl ester

L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, isohexyl ester

InChI
InChI=1S/C17H32ClNO4/c1-13(2)8-6-10-22-16(20)15(12-14(3)4)19(5)17(21)23-11-7-9-18/h13-15H,6-12H2,1-5H3/t15-/m0/s1
InChI Key
QGCZEHTXFJPSPR-HNNXBMFYSA-N
Formula
C17H32ClNO4
SMILES
CC(C)CCCOC(=O)[C@H](CC(C)C)N(C)C(=O)OCCCCl
Molecular Weight1
349.90
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Physical Properties

Property Value Unit Source
ΔfH°gas -1022.28 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 45.17 kJ/mol Joback Calculated Property
ΔvapH° 90.20 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.078 Crippen Calculated Property
McVol 287.490 ml/mol McGowan Calculated Property
Inp [2138.00; 2138.00]   Show Hide
Inp 2138.00 NIST
Inp 2138.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [426.76; 960.51] 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 A3.54070e+01
Coefficient B1.65770e+00
Coefficient C-8.54400e-04
Coefficient D1.21800e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 426.76 J/mol×K 273.00 Calculated Property
Cp,gas 520.32 J/mol×K 353.78 Calculated Property
Cp,gas 604.42 J/mol×K 434.56 Calculated Property
Cp,gas 679.44 J/mol×K 515.33 Calculated Property
Cp,gas 745.77 J/mol×K 596.11 Calculated Property
Cp,gas 803.79 J/mol×K 676.89 Calculated Property
Cp,gas 853.89 J/mol×K 757.67 Calculated Property
Cp,gas 896.45 J/mol×K 838.44 Calculated Property
Cp,gas 931.86 J/mol×K 919.22 Calculated Property
Cp,gas 960.51 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, pentyl ester. L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, hexadecyl ester. L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, tetradecyl ester. L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, octadecyl ester. L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, heptadecyl ester. L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, tridecyl ester. L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, pentadecyl ester. L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, 3-chloropropyl ester. L-Leucine, N-methyl-N-(hexyloxycarbonyl)-, isohexyl ester. L-Leucine, N-methyl-N-(octyloxycarbonyl)-, isohexyl ester. l-Leucine, n-butoxycarbonyl-N-methyl-, pentyl ester. L-Leucine, N-methyl-N-(hexyloxycarbonyl)-, hexyl ester. L-Leucine, N-methyl-N-(hexyloxycarbonyl)-, tetradecyl ester. l-Leucine, N-methyl-n-propoxycarbonyl-, hexyl ester. L-Leucine, N-methyl-N-(octyloxycarbonyl)-, undecyl ester.

Find more compounds similar to L-Leucine, N-methyl-N-(3-chloropropoxycarbonyl)-, isohexyl ester.

Sources

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