Chemical Properties of L-«alpha»-Aminobutyric acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester

L-«alpha»-Aminobutyric acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester

InChI
InChI=1S/C12H23NO4/c1-6-10(13-12(15)16-7-2)11(14)17-9(5)8(3)4/h8-10H,6-7H2,1-5H3,(H,13,15)/t9-,10?/m0/s1
InChI Key
ZHTVAOXHQKTVHZ-RGURZIINSA-N
Formula
C12H23NO4
SMILES
CCOC(=O)NC(CC)C(=O)OC(C)C(C)C
Molecular Weight1
245.32
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Physical Properties

Property Value Unit Source
ΔfusH° 30.10 kJ/mol Joback Calculated Property
logPoct/wat 2.099 Crippen Calculated Property
McVol 204.800 ml/mol McGowan Calculated Property
Inp [1545.50; 1545.50]   Show Hide
Inp 1545.50 NIST
Inp 1545.50 NIST
Tboil 533.89 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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, 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 [307.96; 693.14] 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 A3.65420e+01
Coefficient B1.12820e+00
Coefficient C-4.98000e-04
Coefficient D2.64000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 307.96 J/mol×K 273.00 Calculated Property
Cp,gas 374.51 J/mol×K 353.78 Calculated Property
Cp,gas 434.93 J/mol×K 434.56 Calculated Property
Cp,gas 489.30 J/mol×K 515.33 Calculated Property
Cp,gas 537.70 J/mol×K 596.11 Calculated Property
Cp,gas 580.22 J/mol×K 676.89 Calculated Property
Cp,gas 616.94 J/mol×K 757.67 Calculated Property
Cp,gas 647.95 J/mol×K 838.44 Calculated Property
Cp,gas 673.32 J/mol×K 919.22 Calculated Property
Cp,gas 693.14 J/mol×K 1000.00 Calculated Property

Similar Compounds

D-«alpha»-Aminobutyric acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Valine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Valine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Norvaline, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Glutamic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Glutamic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Leucine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Leucine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Norleucine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Norleucine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Selenomethionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Selenomethionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-«alpha»-Aminoadipic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-«alpha»-Aminoadipic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Methionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester.

Find more compounds similar to L-«alpha»-Aminobutyric acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester.

Sources

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