Chemical Properties of L-methionine, n-caproyl-, methyl ester

L-methionine, n-caproyl-, methyl ester

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InChI
InChI=1S/C12H23NO3S/c1-4-5-6-7-11(14)13-10(8-9-17-3)12(15)16-2/h10H,4-9H2,1-3H3,(H,13,14)
InChI Key
FFRRQECVACLCBP-UHFFFAOYSA-N
Formula
C12H23NO3S
SMILES
CCCCCC(=O)NC(CCSC)C(=O)OC
Molecular Weight1
261.38
Sources

Physical Properties

Property Value Unit Source
Δf -192.61 kJ/mol Joback Calculated Property
Δfgas -558.33 kJ/mol Joback Calculated Property
Δfus 36.93 kJ/mol Joback Calculated Property
Δvap 71.07 kJ/mol Joback Calculated Property
logPoct/wat 1.98 Crippen Calculated Property
Pc 2023.58 kPa Joback Calculated Property
Tboil 722.63 K Joback Calculated Property
Tc 919.66 K Joback Calculated Property
Tfus 419.15 K Joback Calculated Property
Vc 0.82 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 603.12 J/mol×K 722.63 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
>C=O (nonring) 2
-CH2- 6
-S- 1
>NH 1
-CH3 3

Similar Compounds

L-methionine, n-(3-cyclopentylpropionyl)-, methyl ester. L-valine, n-capryloyl-, methyl ester. L-valine, n-butyryl-, methyl ester. L-valine, n-(3-cyclopentylpropionyl)-, methyl ester. L-alanine, n-caproyl-, methyl ester. N-hexanoyl-dl-homoserine lactone. L-alanine, n-capryloyl-, methyl ester. N-capryloyl-dl-homoserine lactone. N-Dodecanoyl-DL-homoserine lactone. N-tetradecanoyl-dl-homoserine lactone. L-methionine, n-acetyl-. L-leucine, n-pivaloyl-, methyl ester. L-methionine, n-(trifluoroacetyl)-, butyl ester. Dl-proline, 5-oxo-, methyl ester. L-alanine, n-(5-chlorovaleryl)-, methyl ester.

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