Chemical Properties of Adipic acid, pentyl 2-propylphenyl ester

Adipic acid, pentyl 2-propylphenyl ester

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InChI
InChI=1S/C20H30O4/c1-3-5-10-16-23-19(21)14-8-9-15-20(22)24-18-13-7-6-12-17(18)11-4-2/h6-7,12-13H,3-5,8-11,14-16H2,1-2H3
InChI Key
XZJKDONPYPWZMW-UHFFFAOYSA-N
Formula
C20H30O4
SMILES
CCCCCOC(=O)CCCCC(=O)Oc1ccccc1CCC
Molecular Weight1
334.45
Sources

Physical Properties

Property Value Unit Source
Δf -247.54 kJ/mol Joback Calculated Property
Δfgas -720.67 kJ/mol Joback Calculated Property
Δfus 46.78 kJ/mol Joback Calculated Property
Δvap 81.36 kJ/mol Joback Calculated Property
logPoct/wat 4.838 Crippen Calculated Property
Pc 1341.76 kPa Joback Calculated Property
Tboil 841.24 K Joback Calculated Property
Tc 1041.25 K Joback Calculated Property
Tfus 498.42 K Joback Calculated Property
Vc 1.095 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 877.72 J/mol×K 841.24 Joback Calculated Property
η 0.0000548 Pa×s 841.24 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 10
>C=O (nonring) 2

Similar Compounds

Adipic acid, hexyl 2-propylphenyl ester. Adipic acid, butyl 2-propylphenyl ester. Adipic acid, decyl 2-propylphenyl ester. Adipic acid, heptyl 2-propylphenyl ester. Adipic acid, pentadecyl 2-propylphenyl ester. Adipic acid, heptadecyl 2-propylphenyl ester. Adipic acid, 2-propylphenyl tetradecyl ester. Adipic acid, octyl 2-propylphenyl ester. Adipic acid, 2-propylphenyl undecyl ester. Adipic acid, hexadecyl 2-propylphenyl ester. Adipic acid, dodecyl 2-propylphenyl ester. Adipic acid, nonyl 2-propylphenyl ester. Adipic acid, 2-propylphenyl tridecyl ester. Adipic acid, propyl 2-propylphenyl ester. Adipic acid, ethyl 2-propylphenyl ester.

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