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

Phthalic acid, hex-3-yl tridecyl ester

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InChI
InChI=1S/C27H44O4/c1-4-7-8-9-10-11-12-13-14-15-18-22-30-26(28)24-20-16-17-21-25(24)27(29)31-23(6-3)19-5-2/h16-17,20-21,23H,4-15,18-19,22H2,1-3H3
InChI Key
QIPVXTAXIXSKRX-UHFFFAOYSA-N
Formula
C27H44O4
SMILES
CCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OC(CC)CCC
Molecular Weight1
432.64
Sources

Physical Properties

Property Value Unit Source
Δf -191.04 kJ/mol Joback Calculated Property
Δfgas -870.43 kJ/mol Joback Calculated Property
Δfus 61.39 kJ/mol Joback Calculated Property
Δvap 96.56 kJ/mol Joback Calculated Property
logPoct/wat 7.89 Crippen Calculated Property
Pc 868.11 kPa Joback Calculated Property
Tboil 1000.96 K Joback Calculated Property
Tc 1226.87 K Joback Calculated Property
Tfus 562.31 K Joback Calculated Property
Vc 1.48 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1306.77 J/mol×K 1000.96 Joback Calculated Property
η 0.00 Pa×s 1000.96 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 3
=CH- (ring) 4
=C< (ring) 2
-CH2- 15
>C=O (nonring) 2

Similar Compounds

Phthalic acid, hex-3-yl pentadecyl 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, dodecyl 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, hex-3-yl tridecyl ester.

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