Chemical Properties of 4-Pentenoic acid, 2-methyl-, dodecyl ester

4-Pentenoic acid, 2-methyl-, dodecyl ester

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InChI
InChI=1S/C18H34O2/c1-4-6-7-8-9-10-11-12-13-14-16-20-18(19)17(3)15-5-2/h5,17H,2,4,6-16H2,1,3H3
InChI Key
OCTXRPXMWDITBY-UHFFFAOYSA-N
Formula
C18H34O2
SMILES
C=CCC(C)C(=O)OCCCCCCCCCCCC
Molecular Weight1
282.46
Sources

Physical Properties

Property Value Unit Source
Δf -47.84 kJ/mol Joback Calculated Property
Δfgas -539.50 kJ/mol Joback Calculated Property
Δfus 40.36 kJ/mol Joback Calculated Property
Δvap 63.76 kJ/mol Joback Calculated Property
logPoct/wat 5.66 Crippen Calculated Property
Pc 1231.15 kPa Joback Calculated Property
Tboil 683.77 K Joback Calculated Property
Tc 855.40 K Joback Calculated Property
Tfus 348.02 K Joback Calculated Property
Vc 1.04 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 766.22 J/mol×K 683.77 Joback Calculated Property
η 0.00 Pa×s 683.77 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
-CH3 2
=CH2 1
-CH2- 12
=CH- 1
>C=O (nonring) 1

Similar Compounds

4-Pentenoic acid, 2-methyl-, pentadecyl ester. 4-Pentenoic acid, 2-methyl-, tridecyl ester. 4-Pentenoic acid, 2-methyl-, octadecyl ester. 4-Pentenoic acid, 2-methyl-, tetradecyl ester. 4-Pentenoic acid, 2-methyl-, heptadecyl ester. 4-Pentenoic acid, 2-methyl-, undecyl ester. 4-Pentenoic acid, 2-methyl-, decyl ester. 4-Pentenoic acid, 2-methyl-, octyl ester. 4-Pentenoic acid, 2-methyl-, nonyl ester. 4-Pentenoic acid, 2-methyl-, hexadecyl ester. 4-Pentenoic acid, 2-methyl-, heptyl ester. 4-Pentenoic acid, 2-methyl-, hexyl ester. 4-Pentenoic acid, 2-methyl-, pentyl ester. 4-Pentenoic acid, 2-methyl-, butyl ester. 4-Pentenoic acid, 2-methyl-, propyl ester.

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