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

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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
Sources

Physical Properties

Property Value Unit Source
Δf -335.61 kJ/mol Joback Calculated Property
Δfgas -742.98 kJ/mol Joback Calculated Property
Δfus 26.94 kJ/mol Joback Calculated Property
Δvap 65.89 kJ/mol Joback Calculated Property
logPoct/wat 2.10 Crippen Calculated Property
Pc 1991.21 kPa Joback Calculated Property
Tboil 675.39 K Joback Calculated Property
Tc 863.40 K Joback Calculated Property
Tfus 376.98 K Joback Calculated Property
Vc 0.77 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 573.09 J/mol×K 675.39 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 3
-O- (nonring) 2
-CH3 5
-CH2- 2
>NH 1
>C=O (nonring) 2

Similar Compounds

D-«alpha»-Aminobutyric acid, 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. D-Lysine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Lysine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Methionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. «alpha»-Aminopimelic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Methionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Ornithine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Ornithine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-«alpha»-Aminoadipic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-«alpha»-Aminoadipic acid, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. Selenoethionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. L-Ethionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester. D-Ethionine, N(O,S)-ethoxycarbonyl, (S)-(+)-3-methyl-2-butyl ester.

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