Chemical Properties of D-alanine, n-ethoxycarbonyl-, pentyl ester

D-alanine, n-ethoxycarbonyl-, pentyl ester

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InChI
InChI=1S/C11H21NO4/c1-4-6-7-8-16-10(13)9(3)12-11(14)15-5-2/h9H,4-8H2,1-3H3,(H,12,14)
InChI Key
ZKVSNJAWCFKQHT-UHFFFAOYSA-N
Formula
C11H21NO4
SMILES
CCCCCOC(=O)C(C)NC(=O)OCC
Molecular Weight1
231.29
Sources

Physical Properties

Property Value Unit Source
Δf -339.15 kJ/mol Joback Calculated Property
Δfgas -711.78 kJ/mol Joback Calculated Property
Δfus 31.40 kJ/mol Joback Calculated Property
Δvap 64.44 kJ/mol Joback Calculated Property
logPoct/wat 1.85 Crippen Calculated Property
Pc 2141.36 kPa Joback Calculated Property
Tboil 653.39 K Joback Calculated Property
Tc 837.00 K Joback Calculated Property
Tfus 395.71 K Joback Calculated Property
Vc 0.73 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 519.38 J/mol×K 653.39 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

D-alanine, n-ethoxycarbonyl-, hexyl ester. D-alanine, n-butoxycarbonyl-, pentyl ester. D-alanine, n-ethoxycarbonyl-, heptyl ester. D-alanine, n-ethoxycarbonyl-, heptadecyl ester. D-alanine, n-ethoxycarbonyl-, octyl ester. D-alanine, n-ethoxycarbonyl-, nonyl ester. D-alanine, n-butoxycarbonyl-, hexyl ester. D-alanine, n-butoxycarbonyl-, hexadecyl ester. D-alanine, n-butoxycarbonyl-, dodecyl ester. D-alanine, n-butoxycarbonyl-, octadecyl ester. D-alanine, n-allyloxycarbonyl-, nonyl ester. D-alanine, n-propargyloxycarbonyl-, dodecyl ester. D-alanine, n-propargyloxycarbonyl-, tridecyl ester. D-alanine, n-allyloxycarbonyl-, tridecyl ester. D-alanine, n-neopentyloxycarbonyl-, hexyl ester.

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