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

L-valine, n-capryloyl-, methyl ester

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InChI
InChI=1S/C14H27NO3/c1-5-6-7-8-9-10-12(16)15-13(11(2)3)14(17)18-4/h11,13H,5-10H2,1-4H3,(H,15,16)
InChI Key
BBEXIDMPTFADQN-UHFFFAOYSA-N
Formula
C14H27NO3
SMILES
CCCCCCCC(=O)NC(C(=O)OC)C(C)C
Molecular Weight1
257.37
Sources

Physical Properties

Property Value Unit Source
Δf -211.33 kJ/mol Joback Calculated Property
Δfgas -646.76 kJ/mol Joback Calculated Property
Δfus 34.45 kJ/mol Joback Calculated Property
Δvap 68.32 kJ/mol Joback Calculated Property
logPoct/wat 2.661 Crippen Calculated Property
Pc 1701.90 kPa Joback Calculated Property
Tboil 699.17 K Joback Calculated Property
Tc 882.83 K Joback Calculated Property
Tfus 392.29 K Joback Calculated Property
Vc 0.873 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 653.04 J/mol×K 699.17 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 1
>C=O (nonring) 2
-CH2- 6
>NH 1
-CH3 4

Similar Compounds

L-valine, n-(3-cyclopentylpropionyl)-, methyl ester. L-valine, n-butyryl-, methyl ester. Dl-valine, n-acetyl-, methyl ester. L-methionine, n-caproyl-, methyl ester. L-alanine, n-capryloyl-, methyl ester. L-methionine, n-(3-cyclopentylpropionyl)-, methyl ester. L-leucine, n-pivaloyl-, methyl ester. L-alanine, n-caproyl-, methyl ester. N-Dodecanoyl-DL-homoserine lactone. N-capryloyl-dl-homoserine lactone. N-tetradecanoyl-dl-homoserine lactone. N-hexanoyl-dl-homoserine lactone. (-) Jasmonic acid - (S)-Val conjugate, methyl ester. (+)-Jasmonic acid - (S)-Val conjugate, methyl ester. (-)-Jasmonic acid - (R)-Val conjugate, methyl ester.

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