Chemical Properties of Terephthalic acid, but-2-enyl isohexyl ester

Terephthalic acid, but-2-enyl isohexyl ester

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InChI
InChI=1S/C18H24O4/c1-4-5-12-21-17(19)15-8-10-16(11-9-15)18(20)22-13-6-7-14(2)3/h4-5,8-11,14H,6-7,12-13H2,1-3H3/b5-4+
InChI Key
QWLCAMQBZSYWOM-SNAWJCMRSA-N
Formula
C18H24O4
SMILES
CC=CCOC(=O)c1ccc(C(=O)OCCCC(C)C)cc1
Molecular Weight1
304.38
Sources

Physical Properties

Property Value Unit Source
Δf -186.60 kJ/mol Joback Calculated Property
Δfgas -567.45 kJ/mol Joback Calculated Property
Δfus 38.28 kJ/mol Joback Calculated Property
Δvap 76.48 kJ/mol Joback Calculated Property
logPoct/wat 4.01 Crippen Calculated Property
Pc 1628.54 kPa Joback Calculated Property
Tboil 799.20 K Joback Calculated Property
Tc 1006.70 K Joback Calculated Property
Tfus 455.80 K Joback Calculated Property
Vc 0.96 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 736.28 J/mol×K 799.2 Joback Calculated Property
η 0.00 Pa×s 799.2 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- 4
=CH- 2
-CH3 3

Similar Compounds

Terephthalic acid, but-2-enyl pentyl ester. Terephthalic acid, but-2-enyl hexyl ester. Terephthalic acid, but-2-enyl heptyl ester. Terephthalic acid, but-2-enyl tridecyl ester. Terephthalic acid, but-2-enyl pentadecyl ester. Terephthalic acid, but-2-enyl nonyl ester. Terephthalic acid, but-2-enyl hexadecyl ester. Terephthalic acid, but-2-enyl undecyl ester. Terephthalic acid, but-2-enyl decyl ester. Terephthalic acid, but-2-enyl octyl ester. Terephthalic acid, but-2-enyl tetradecyl ester. Terephthalic acid, but-2-enyl dodecyl ester. Terephthalic acid, dodec-2-enyl isohexyl ester. Terephthalic acid, isohexyl 3-methylbutyl ester. Terephthalic acid, but-3-enyl isohexyl ester.

Find more compounds similar to Terephthalic acid, but-2-enyl isohexyl ester.

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