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

«beta»-Aminoisobutyric acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester

InChI
InChI=1S/C12H23NO4/c1-6-16-12(15)13-7-9(4)11(14)17-10(5)8(2)3/h8-10H,6-7H2,1-5H3,(H,13,15)/t9?,10-/m1/s1
InChI Key
FFXZTIJHVQTSIA-QVDQXJPCSA-N
Formula
C12H23NO4
SMILES
CCOC(=O)NCC(C)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 1.956 Crippen Calculated Property
McVol 204.800 ml/mol McGowan Calculated Property
Inp [1571.00; 1579.10]   Show Hide
Inp 1571.00 NIST
Inp 1579.10 NIST
Tboil 538.45 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [561.24; 642.41] J/mol×K [639.45; 822.88] Show Hide
Cp,gas 561.24 J/mol×K 639.45 Joback Calculated Property
Cp,gas 576.83 J/mol×K 670.02 Joback Calculated Property
Cp,gas 591.60 J/mol×K 700.59 Joback Calculated Property
Cp,gas 605.53 J/mol×K 731.17 Joback Calculated Property
Cp,gas 618.64 J/mol×K 761.74 Joback Calculated Property
Cp,gas 630.93 J/mol×K 792.31 Joback Calculated Property
Cp,gas 642.41 J/mol×K 822.88 Joback Calculated Property

Similar Compounds

D-2,3-Diaminopropionic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Valine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Valine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-2,3-Diaminopropionic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-«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. D-Aspartic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Aspartic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Lysine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Lysine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-allo-Isoleucine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Isoleucine, 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-Glutamic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester.

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

Sources

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