Chemical Properties of L-alanine, n-capryloyl-, methyl ester

L-alanine, n-capryloyl-, methyl ester

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InChI
InChI=1S/C12H23NO3/c1-4-5-6-7-8-9-11(14)13-10(2)12(15)16-3/h10H,4-9H2,1-3H3,(H,13,14)
InChI Key
QTGVLHBHHGTRST-UHFFFAOYSA-N
Formula
C12H23NO3
SMILES
CCCCCCCC(=O)NC(C)C(=O)OC
Molecular Weight1
229.32
Sources

Physical Properties

Property Value Unit Source
Δf -225.73 kJ/mol Joback Calculated Property
Δfgas -600.20 kJ/mol Joback Calculated Property
Δfus 32.80 kJ/mol Joback Calculated Property
Δvap 64.26 kJ/mol Joback Calculated Property
logPoct/wat 2.02 Crippen Calculated Property
Pc 1992.98 kPa Joback Calculated Property
Tboil 653.85 K Joback Calculated Property
Tc 836.74 K Joback Calculated Property
Tfus 384.75 K Joback Calculated Property
Vc 0.77 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 544.56 J/mol×K 653.85 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

L-alanine, n-caproyl-, methyl ester. L-alanine, n-butyryl-, methyl ester. L-alanine, n-(5-chlorovaleryl)-, methyl ester. L-valine, n-capryloyl-, methyl ester. D-alanine, n-(5-chlorovaleryl)-, butyl ester. L-alanine, n-pivaloyl-, methyl ester. D-alanine, n-(5-chlorovaleryl)-, isobutyl ester. D-alanine, n-(5-chlorovaleryl)-, octyl ester. D-alanine, n-(5-chlorovaleryl)-, pentyl ester. D-alanine, n-(5-chlorovaleryl)-, heptyl ester. N-capryloyl-dl-homoserine lactone. N-tetradecanoyl-dl-homoserine lactone. N-Dodecanoyl-DL-homoserine lactone. D-alanine, n-(5-chlorovaleryl)-, hexyl ester. D-alanine, n-(5-chlorovaleryl)-, isohexyl ester.

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