Chemical Properties of Phthalic acid, dodecyl hex-3-yl ester

Phthalic acid, dodecyl hex-3-yl ester

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InChI
InChI=1S/C26H42O4/c1-4-7-8-9-10-11-12-13-14-17-21-29-25(27)23-19-15-16-20-24(23)26(28)30-22(6-3)18-5-2/h15-16,19-20,22H,4-14,17-18,21H2,1-3H3
InChI Key
QKKKGMKEKPKSRR-UHFFFAOYSA-N
Formula
C26H42O4
SMILES
CCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OC(CC)CCC
Molecular Weight1
418.61
Sources

Physical Properties

Property Value Unit Source
Δf -199.46 kJ/mol Joback Calculated Property
Δfgas -849.79 kJ/mol Joback Calculated Property
Δfus 58.80 kJ/mol Joback Calculated Property
Δvap 94.33 kJ/mol Joback Calculated Property
logPoct/wat 7.50 Crippen Calculated Property
Pc 919.39 kPa Joback Calculated Property
Tboil 978.08 K Joback Calculated Property
Tc 1197.65 K Joback Calculated Property
Tfus 551.04 K Joback Calculated Property
Vc 1.43 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1244.04 J/mol×K 978.08 Joback Calculated Property
η 0.00 Pa×s 978.08 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
=C< (ring) 2
-CH2- 14
-CH3 3

Similar Compounds

Phthalic acid, hex-3-yl pentadecyl ester. Phthalic acid, hex-3-yl tridecyl ester. Phthalic acid, hex-3-yl nonyl ester. Phthalic acid, hex-3-yl octyl ester. Phthalic acid, hexadecyl hex-3-yl ester. Phthalic acid, hex-3-yl undecyl ester. Phthalic acid, decyl hex-3-yl ester. Phthalic acid, heptyl hex-3-yl ester. Phthalic acid, hept-4-yl pentadecyl ester. Phthalic acid, hept-4-yl nonyl ester. Phthalic acid, hept-4-yl tetradecyl ester. Phthalic acid, hept-4-yl undecyl ester. Phthalic acid, hept-4-yl octadecyl ester. Phthalic acid, heptadecyl hept-4-yl ester. Phthalic acid, hept-4-yl tridecyl ester.

Find more compounds similar to Phthalic acid, dodecyl hex-3-yl ester.

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