Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, pentadecyl 3-pentyl ester

1,2-Cyclohexanedicarboxylic acid, pentadecyl 3-pentyl ester

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InChI
InChI=1S/C28H52O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-20-23-31-27(29)25-21-18-19-22-26(25)28(30)32-24(5-2)6-3/h24-26H,4-23H2,1-3H3
InChI Key
PSDNEWIVUHOEKV-UHFFFAOYSA-N
Formula
C28H52O4
SMILES
CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)OC(CC)CC
Molecular Weight1
452.71
Sources

Physical Properties

Property Value Unit Source
Δf -268.66 kJ/mol Joback Calculated Property
Δfgas -1082.15 kJ/mol Joback Calculated Property
Δfus 63.23 kJ/mol Joback Calculated Property
Δvap 95.97 kJ/mol Joback Calculated Property
logPoct/wat 8.16 Crippen Calculated Property
Pc 757.23 kPa Joback Calculated Property
Tboil 1007.06 K Joback Calculated Property
Tc 1237.11 K Joback Calculated Property
Tfus 537.78 K Joback Calculated Property
Vc 1.58 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1475.18 J/mol×K 1007.06 Joback Calculated Property
η 0.00 Pa×s 1007.06 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
-CH2- 16
-CH3 3
>CH- (ring) 2
-CH2- (ring) 4

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, dodecyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, octadecyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, hexyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-pentyl undecyl ester. 1,2-Cyclohexanedicarboxylic acid, 3-pentyl tetradecyl ester. 1,2-Cyclohexanedicarboxylic acid, hexadecyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, nonyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, octyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, decyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, heptyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, pentyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, ethyl 3-pentyl ester. 1,2-Cyclohexanedicarboxylic acid, di(3-pentyl) ester. 1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl octadecyl ester. 1,2-Cyclohexanedicarboxylic acid, dodecyl 2-methylpent-3-yl ester.

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