Chemical Properties of Diethylmalonic acid, monochloride, 4-bromo-2-methoxyphenyl ester

Diethylmalonic acid, monochloride, 4-bromo-2-methoxyphenyl ester

InChI
InChI=1S/C14H16BrClO4/c1-4-14(5-2,12(16)17)13(18)20-10-7-6-9(15)8-11(10)19-3/h6-8H,4-5H2,1-3H3
InChI Key
QIRIDLNLOMJESS-UHFFFAOYSA-N
Formula
C14H16BrClO4
SMILES
CCC(CC)(C(=O)Cl)C(=O)Oc1ccc(Br)cc1OC
Molecular Weight1
363.63
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Physical Properties

Property Value Unit Source
ΔfusH° 34.50 kJ/mol Joback Calculated Property
logPoct/wat 3.935 Crippen Calculated Property
McVol 228.980 ml/mol McGowan Calculated Property
Inp 2130.00 NIST
Tboil 607.28 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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 [598.13; 655.00] J/mol×K [791.43; 1019.62] Show Hide
Cp,gas 598.13 J/mol×K 791.43 Joback Calculated Property
Cp,gas 610.10 J/mol×K 829.46 Joback Calculated Property
Cp,gas 621.01 J/mol×K 867.49 Joback Calculated Property
Cp,gas 630.92 J/mol×K 905.52 Joback Calculated Property
Cp,gas 639.86 J/mol×K 943.55 Joback Calculated Property
Cp,gas 647.87 J/mol×K 981.58 Joback Calculated Property
Cp,gas 655.00 J/mol×K 1019.62 Joback Calculated Property
η [0.0000632; 0.0005440] Pa×s [505.63; 791.43] Show Hide
η 0.0005440 Pa×s 505.63 Joback Calculated Property
η 0.0003256 Pa×s 553.26 Joback Calculated Property
η 0.0002114 Pa×s 600.90 Joback Calculated Property
η 0.0001463 Pa×s 648.53 Joback Calculated Property
η 0.0001064 Pa×s 696.16 Joback Calculated Property
η 0.0000807 Pa×s 743.80 Joback Calculated Property
η 0.0000632 Pa×s 791.43 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, di(4-bromo-2-methoxyphenyl) ester. Diethylmalonic acid, monochloride, 2,6-dimethoxyphenyl ester. Diethylmalonic acid, monochloride, 4-fluoro-2-methoxyphenyl ester. Diethylmalonic acid, monochloride, 2-isopropoxyphenyl ester. Diethylmalonic acid, monochloride, 4-bromophenyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl ethyl ester. Diethylmalonic acid, monochloride, 3-methoxyphenyl ester. 2-Ethylbutyric acid, 4-bromo-2-methoxyphenyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl propyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl pentyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl butyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl isobutyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl hexyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl octyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl nonyl ester.

Find more compounds similar to Diethylmalonic acid, monochloride, 4-bromo-2-methoxyphenyl ester.

Sources

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