Chemical Properties of D-alanine, n-neopentyloxycarbonyl-, tetradecyl ester

D-alanine, n-neopentyloxycarbonyl-, tetradecyl ester

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InChI
InChI=1S/C23H45NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-27-21(25)20(2)24-22(26)28-19-23(3,4)5/h20H,6-19H2,1-5H3,(H,24,26)
InChI Key
AOQKGYSNHFYTQJ-UHFFFAOYSA-N
Formula
C23H45NO4
SMILES
CCCCCCCCCCCCCCOC(=O)C(C)NC(=O)OCC(C)(C)C
Molecular Weight1
399.61
Sources

Physical Properties

Property Value Unit Source
Δf -235.27 kJ/mol Joback Calculated Property
Δfgas -968.21 kJ/mol Joback Calculated Property
Δfus 55.06 kJ/mol Joback Calculated Property
Δvap 89.86 kJ/mol Joback Calculated Property
logPoct/wat 6.39 Crippen Calculated Property
Pc 921.62 kPa Joback Calculated Property
Tboil 924.72 K Joback Calculated Property
Tc 1132.42 K Joback Calculated Property
Tfus 533.37 K Joback Calculated Property
Vc 1.39 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1220.46 J/mol×K 924.72 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
-CH2- 14
>C< 1
>NH 1
-CH3 5

Similar Compounds

D-alanine, n-neopentyloxycarbonyl-, octadecyl ester. D-alanine, n-neopentyloxycarbonyl-, undecyl ester. D-alanine, n-neopentyloxycarbonyl-, decyl ester. D-alanine, n-neopentyloxycarbonyl-, tridecyl ester. D-alanine, n-neopentyloxycarbonyl-, heptyl ester. D-alanine, n-neopentyloxycarbonyl-, hexyl ester. D-alanine, n-butoxycarbonyl-, dodecyl ester. D-alanine, n-butoxycarbonyl-, hexadecyl ester. D-alanine, n-butoxycarbonyl-, octadecyl ester. D-alanine, n-butoxycarbonyl-, hexyl ester. D-alanine, n-ethoxycarbonyl-, nonyl ester. D-alanine, n-ethoxycarbonyl-, octyl ester. D-alanine, n-ethoxycarbonyl-, heptadecyl ester. D-alanine, n-ethoxycarbonyl-, heptyl ester. D-alanine, n-ethoxycarbonyl-, hexyl ester.

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