Chemical Properties of Diethylmalonic acid, monochloride, 2-isopropoxyphenyl ester

Diethylmalonic acid, monochloride, 2-isopropoxyphenyl ester

InChI
InChI=1S/C16H21ClO4/c1-5-16(6-2,14(17)18)15(19)21-13-10-8-7-9-12(13)20-11(3)4/h7-11H,5-6H2,1-4H3
InChI Key
ASUNEVXLSQBBSM-UHFFFAOYSA-N
Formula
C16H21ClO4
SMILES
CCC(CC)(C(=O)Cl)C(=O)Oc1ccccc1OC(C)C
Molecular Weight1
312.79
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Physical Properties

Property Value Unit Source
ΔfusH° 31.26 kJ/mol Joback Calculated Property
log10WS -3.94 Relay (1.0) Calculated Property
logPoct/wat 3.951 Crippen Calculated Property
McVol 239.660 ml/mol McGowan Calculated Property
Inp [1938.00; 1938.00]   Show Hide
Inp 1938.00 NIST
Inp 1938.00 NIST
Tfus 335.81 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, 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 [672.94; 744.55] J/mol×K [765.61; 980.85] Show Hide
Cp,gas 672.94 J/mol×K 765.61 Joback Calculated Property
Cp,gas 687.62 J/mol×K 801.48 Joback Calculated Property
Cp,gas 701.15 J/mol×K 837.36 Joback Calculated Property
Cp,gas 713.57 J/mol×K 873.23 Joback Calculated Property
Cp,gas 724.92 J/mol×K 909.11 Joback Calculated Property
Cp,gas 735.23 J/mol×K 944.98 Joback Calculated Property
Cp,gas 744.55 J/mol×K 980.85 Joback Calculated Property
η [0.0000550; 0.0009919] Pa×s [440.85; 765.61] Show Hide
η 0.0009919 Pa×s 440.85 Joback Calculated Property
η 0.0004705 Pa×s 494.98 Joback Calculated Property
η 0.0002585 Pa×s 549.10 Joback Calculated Property
η 0.0001582 Pa×s 603.23 Joback Calculated Property
η 0.0001049 Pa×s 657.36 Joback Calculated Property
η 0.0000741 Pa×s 711.48 Joback Calculated Property
η 0.0000550 Pa×s 765.61 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, monochloride, 2,6-dimethoxyphenyl ester. Diethylmalonic acid, di(2-isopropoxyphenyl) ester. Diethylmalonic acid, monochloride, 4-fluoro-2-methoxyphenyl ester. Diethylmalonic acid, monochloride, 4-bromo-2-methoxyphenyl ester. Diethylmalonic acid, monochloride, 3-methoxyphenyl ester. Diethylmalonic acid, ethyl 2-isopropoxyphenyl ester. Diethylmalonic acid, monochloride, 2-chlorophenyl ester. 2-Ethylbutyric acid, 2-isopropoxyphenyl ester. Diethylmalonic acid, monochloride, 2,4-dichlorophenyl ester. Diethylmalonic acid, monochloride, 4-chlorophenyl ester. Diethylmalonic acid, monochloride, 2-fluorophenyl ester. Diethylmalonic acid, monochloride, 2,3-dichlorophenyl ester. Diethylmalonic acid, isobutyl 2-isopropoxyphenyl ester. Diethylmalonic acid, monochloride, 4-bromophenyl ester. Diethylmalonic acid, butyl 2-isopropoxyphenyl ester.

Find more compounds similar to Diethylmalonic acid, monochloride, 2-isopropoxyphenyl ester.

Sources

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