Chemical Properties of Dimethylmalonic acid, 2-isopropoxyphenyl tridecyl ester

Dimethylmalonic acid, 2-isopropoxyphenyl tridecyl ester

InChI
InChI=1S/C27H44O5/c1-6-7-8-9-10-11-12-13-14-15-18-21-30-25(28)27(4,5)26(29)32-24-20-17-16-19-23(24)31-22(2)3/h16-17,19-20,22H,6-15,18,21H2,1-5H3
InChI Key
RPYOAPUFBGYSDH-UHFFFAOYSA-N
Formula
C27H44O5
SMILES
CCCCCCCCCCCCCOC(=O)C(C)(C)C(=O)Oc1ccccc1OC(C)C
Molecular Weight1
448.64
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Physical Properties

Property Value Unit Source
ΔfusH° 58.33 kJ/mol Joback Calculated Property
log10WS -6.61 Relay (1.0) Calculated Property
logPoct/wat 7.260 Crippen Calculated Property
McVol 388.280 ml/mol McGowan Calculated Property
Pc 828.59 kPa Joback Calculated Property
Inp 2851.00 NIST
Tboil 653.31 K Relay (1.0) Calculated Property
Tfus 305.14 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 [1320.00; 1396.68] J/mol×K [984.21; 1205.17] Show Hide
Cp,gas 1320.00 J/mol×K 984.21 Joback Calculated Property
Cp,gas 1336.85 J/mol×K 1021.04 Joback Calculated Property
Cp,gas 1351.99 J/mol×K 1057.86 Joback Calculated Property
Cp,gas 1365.47 J/mol×K 1094.69 Joback Calculated Property
Cp,gas 1377.38 J/mol×K 1131.52 Joback Calculated Property
Cp,gas 1387.76 J/mol×K 1168.35 Joback Calculated Property
Cp,gas 1396.68 J/mol×K 1205.17 Joback Calculated Property
η [0.0000074; 0.0002554] Pa×s [527.30; 984.21] Show Hide
η 0.0002554 Pa×s 527.30 Joback Calculated Property
η 0.0000977 Pa×s 603.45 Joback Calculated Property
η 0.0000464 Pa×s 679.60 Joback Calculated Property
η 0.0000256 Pa×s 755.75 Joback Calculated Property
η 0.0000157 Pa×s 831.91 Joback Calculated Property
η 0.0000105 Pa×s 908.06 Joback Calculated Property
η 0.0000074 Pa×s 984.21 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, heptyl 2-isopropoxyphenyl ester. Dimethylmalonic acid, 2-isopropoxyphenyl pentadecyl ester. Dimethylmalonic acid, dodecyl 2-isopropoxyphenyl ester. Dimethylmalonic acid, 2-isopropoxyphenyl octyl ester. Dimethylmalonic acid, decyl 2-isopropoxyphenyl ester. Dimethylmalonic acid, 2-isopropoxyphenyl nonyl ester. Dimethylmalonic acid, 2-isopropoxyphenyl tetradecyl ester. Dimethylmalonic acid, 2-isopropoxyphenyl undecyl ester. Dimethylmalonic acid, heptadecyl 2-isopropoxyphenyl ester. Dimethylmalonic acid, hexadecyl 2-isopropoxyphenyl ester. Dimethylmalonic acid, 2-isopropoxyphenyl pentyl ester. Dimethylmalonic acid, butyl 2-isopropoxyphenyl ester. Dimethylmalonic acid, isohexyl 2-isopropoxyphenyl ester. Diethylmalonic acid, heptadecyl 2-isopropoxyphenyl ester. Diethylmalonic acid, 2-isopropoxyphenyl tridecyl ester.

Find more compounds similar to Dimethylmalonic acid, 2-isopropoxyphenyl tridecyl ester.

Sources

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