Chemical Properties of L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, octadecyl ester

L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, octadecyl ester

InChI
InChI=1S/C30H55NO4/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-34-29(32)28(26-27(3)4)31(5)30(33)35-24-9-7-2/h2,27-28H,6,8-26H2,1,3-5H3/t28-/m0/s1
InChI Key
JKGBFCJMPUNNNN-NDEPHWFRSA-N
Formula
C30H55NO4
SMILES
C#CCCOC(=O)N(C)[C@@H](CC(C)C)C(=O)OCCCCCCCCCCCCCCCCCC
Molecular Weight1
493.77
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Physical Properties

Property Value Unit Source
ΔfusH° 81.14 kJ/mol Joback Calculated Property
log10WS -7.83 Relay (1.0) Calculated Property
logPoct/wat 8.297 Crippen Calculated Property
McVol 449.820 ml/mol McGowan Calculated Property
Inp [3128.00; 3128.00]   Show Hide
Inp 3128.00 NIST
Inp 3128.00 NIST
Tboil 710.41 K Relay (1.0) Calculated Property
Tfus 316.28 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, 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 [678.26; 1564.70] 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 A2.61600e+01
Coefficient B2.78608e+00
Coefficient C-1.53393e-03
Coefficient D2.86390e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 678.26 J/mol×K 273.00 Calculated Property
Cp,gas 832.51 J/mol×K 353.78 Calculated Property
Cp,gas 970.70 J/mol×K 434.56 Calculated Property
Cp,gas 1093.75 J/mol×K 515.33 Calculated Property
Cp,gas 1202.56 J/mol×K 596.11 Calculated Property
Cp,gas 1298.03 J/mol×K 676.89 Calculated Property
Cp,gas 1381.08 J/mol×K 757.67 Calculated Property
Cp,gas 1452.60 J/mol×K 838.44 Calculated Property
Cp,gas 1513.51 J/mol×K 919.22 Calculated Property
Cp,gas 1564.70 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, decyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, octyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, hexadecyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, undecyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, nonyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, heptadecyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, pentadecyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, tetradecyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, hexyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, pentyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, isohexyl ester. L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, butyl ester. l-Leucine, N-methyl-n-propoxycarbonyl-, heptadecyl ester. l-Leucine, N-methyl-n-propoxycarbonyl-, octadecyl ester. L-Leucine, N-methyl-N-(hexyloxycarbonyl)-, heptyl ester.

Find more compounds similar to L-Leucine, N-methyl-N-(but-3-yn-1-yloxycarbonyl)-, octadecyl ester.

Sources

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