Chemical Properties of Isophthalic acid, (2-chlorocyclohexyl)methyl propyl ester

Isophthalic acid, (2-chlorocyclohexyl)methyl propyl ester

InChI
InChI=1S/C18H23ClO4/c1-2-10-22-17(20)13-7-5-8-14(11-13)18(21)23-12-15-6-3-4-9-16(15)19/h5,7-8,11,15-16H,2-4,6,9-10,12H2,1H3
InChI Key
DBSSYZFDKJBEGH-UHFFFAOYSA-N
Formula
C18H23ClO4
SMILES
CCCOC(=O)c1cccc(C(=O)OCC2CCCCC2Cl)c1
Molecular Weight1
338.83
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Physical Properties

Property Value Unit Source
ΔfusH° 41.87 kJ/mol Joback Calculated Property
log10WS -5.33 Relay (1.0) Calculated Property
logPoct/wat 4.208 Crippen Calculated Property
McVol 256.980 ml/mol McGowan Calculated Property
Pc 1619.37 kPa Joback Calculated Property
Tboil 673.14 K Relay (1.0) Calculated Property
Tfus 315.69 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [775.12; 850.80] J/mol×K [811.85; 1034.61] Show Hide
Cp,gas 775.12 J/mol×K 811.85 Joback Calculated Property
Cp,gas 791.61 J/mol×K 848.98 Joback Calculated Property
Cp,gas 806.51 J/mol×K 886.10 Joback Calculated Property
Cp,gas 819.85 J/mol×K 923.23 Joback Calculated Property
Cp,gas 831.67 J/mol×K 960.36 Joback Calculated Property
Cp,gas 841.98 J/mol×K 997.48 Joback Calculated Property
Cp,gas 850.80 J/mol×K 1034.61 Joback Calculated Property
η [0.0000647; 0.0010623] Pa×s [449.28; 811.85] Show Hide
η 0.0010623 Pa×s 449.28 Joback Calculated Property
η 0.0005054 Pa×s 509.71 Joback Calculated Property
η 0.0002815 Pa×s 570.14 Joback Calculated Property
η 0.0001754 Pa×s 630.56 Joback Calculated Property
η 0.0001187 Pa×s 690.99 Joback Calculated Property
η 0.0000855 Pa×s 751.42 Joback Calculated Property
η 0.0000647 Pa×s 811.85 Joback Calculated Property

Similar Compounds

Isophthalic acid, (2-chlorocyclohexyl)methyl heptyl ester. Isophthalic acid, (2-chlorocyclohexyl)methyl hexyl ester. Isophthalic acid, (2-chlorocyclohexyl)methyl pentyl ester. Isophthalic acid, (2-chlorocyclohexyl)methyl isobutyl ester. Isophthalic acid, (2-chlorocyclohexyl)methyl isohexyl ester. Isophthalic acid, di(2-chlorocyclohexyl)methyl ester. Isophthalic acid, cyclohexylmethyl propyl ester. Isophthalic acid, butyl cyclohexylmethyl ester. Isophthalic acid, cyclohexylmethyl pentyl ester. Isophthalic acid, cyclohexylmethyl decyl ester. Isophthalic acid, cyclohexylmethyl nonyl ester. Isophthalic acid, cyclohexylmethyl hexyl ester. Isophthalic acid, cyclohexylmethyl undecyl ester. Isophthalic acid, cyclohexylmethyl octyl ester. Isophthalic acid, cyclohexylmethyl dodecyl ester.

Find more compounds similar to Isophthalic acid, (2-chlorocyclohexyl)methyl propyl ester.

Sources

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