Chemical Properties of Cyanoacetic acid, heptadecyl ester

Cyanoacetic acid, heptadecyl ester

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InChI
InChI=1S/C20H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23-20(22)17-18-21/h2-17,19H2,1H3
InChI Key
DEGKIJNOTWCZBX-UHFFFAOYSA-N
Formula
C20H37NO2
SMILES
CCCCCCCCCCCCCCCCCOC(=O)CC#N
Molecular Weight1
323.51
Sources

Physical Properties

Property Value Unit Source
Δf 16.78 kJ/mol Joback Calculated Property
Δfgas -536.05 kJ/mol Joback Calculated Property
Δfus 51.85 kJ/mol Joback Calculated Property
Δvap 79.75 kJ/mol Joback Calculated Property
logPoct/wat 6.31 Crippen Calculated Property
Pc 1029.26 kPa Joback Calculated Property
Tboil 835.37 K Joback Calculated Property
Tc 1025.02 K Joback Calculated Property
Tfus 452.31 K Joback Calculated Property
Vc 1.21 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 955.13 J/mol×K 835.37 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CN 1
-CH2- 17
>C=O (nonring) 1
-CH3 1

Similar Compounds

Cyanoacetic acid, octyl ester. Cyanoacetic acid, pentadecyl ester. Cyanoacetic acid, nonyl ester. Cyanoacetic acid, dodecyl ester. Cyanoacetic acid, hexadecyl ester. Cyanoacetic acid, octadecyl ester. Cyanoacetic acid, heptyl ester. Cyanoacetic acid, hexyl ester. n-Butyl cyanoacetate. Propanoic acid, decyl ester. 1-Docosanol, propanoate. Dodecyl propionate. Propanoic acid, hexadecyl ester. PROPANOIC ACID, NONYL ESTER. Eicosanyl propionate.

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