Chemical Properties of Fumaric acid, 2-ethylphenyl isohexyl ester

Fumaric acid, 2-ethylphenyl isohexyl ester

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InChI
InChI=1S/C18H24O4/c1-4-15-9-5-6-10-16(15)22-18(20)12-11-17(19)21-13-7-8-14(2)3/h5-6,9-12,14H,4,7-8,13H2,1-3H3/b12-11+
InChI Key
XMOHGIDTAKRSPI-VAWYXSNFSA-N
Formula
C18H24O4
SMILES
CCc1ccccc1OC(=O)C=CC(=O)OCCCC(C)C
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 3.69 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

Fumaric acid, butyl 2-ethylphenyl ester. Fumaric acid, isohexyl 2-propylphenyl ester. Fumaric acid, 2-ethylphenyl isobutyl ester. Fumaric acid, pentyl 2-propylphenyl ester. Fumaric acid, hexyl 2-propylphenyl ester. Fumaric acid, butyl 2-propylphenyl ester. Fumaric acid, 2-isopropylphenyl 8-chlorooctyl ester. Fumaric acid, propyl 2-propylphenyl ester. Fumaric acid, 2-isopropylphenyl 2-ethylhexyl ester. Fumaric acid, isobutyl 2-propylphenyl ester. Fumaric acid, ethyl 2-propylphenyl ester. Fumaric acid, 2-methylphenyl 8-chlorooctyl ester. Fumaric acid, 2-isopropylphenyl 2-methylpent-3-yl ester. Fumaric acid, 2-isopropylphenyl dodec-2-en-1-yl ester. Fumaric acid, di(2-ethylphenyl) ester.

Find more compounds similar to Fumaric acid, 2-ethylphenyl isohexyl ester.

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