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

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

InChI
InChI=1S/C16H21BrO5/c1-5-16(6-2,14(18)21-7-3)15(19)22-12-9-8-11(17)10-13(12)20-4/h8-10H,5-7H2,1-4H3
InChI Key
WJRNSZVOAVWJBH-UHFFFAOYSA-N
Formula
C16H21BrO5
SMILES
CCOC(=O)C(CC)(CC)C(=O)Oc1ccc(Br)cc1OC
Molecular Weight1
373.24
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Physical Properties

Property Value Unit Source
ΔfusH° 38.26 kJ/mol Joback Calculated Property
logPoct/wat 3.733 Crippen Calculated Property
McVol 250.790 ml/mol McGowan Calculated Property
Inp 2193.00 NIST
Tboil 624.68 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 [705.98; 769.67] J/mol×K [804.11; 1020.08] Show Hide
Cp,gas 705.98 J/mol×K 804.11 Joback Calculated Property
Cp,gas 719.46 J/mol×K 840.11 Joback Calculated Property
Cp,gas 731.76 J/mol×K 876.10 Joback Calculated Property
Cp,gas 742.91 J/mol×K 912.10 Joback Calculated Property
Cp,gas 752.92 J/mol×K 948.09 Joback Calculated Property
Cp,gas 761.84 J/mol×K 984.09 Joback Calculated Property
Cp,gas 769.67 J/mol×K 1020.08 Joback Calculated Property
η [0.0000363; 0.0004523] Pa×s [490.65; 804.11] Show Hide
η 0.0004523 Pa×s 490.65 Joback Calculated Property
η 0.0002426 Pa×s 542.89 Joback Calculated Property
η 0.0001452 Pa×s 595.14 Joback Calculated Property
η 0.0000944 Pa×s 647.38 Joback Calculated Property
η 0.0000655 Pa×s 699.62 Joback Calculated Property
η 0.0000478 Pa×s 751.87 Joback Calculated Property
η 0.0000363 Pa×s 804.11 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 4-bromo-2-methoxyphenyl propyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl butyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl isobutyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl pentyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl hexyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl decyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl nonyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl octyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl dodecyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl tetradecyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl heptyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl undecyl ester. Diethylmalonic acid, di(4-bromo-2-methoxyphenyl) ester. Diethylmalonic acid, 2,6-dimethoxyphenyl ethyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl propyl ester.

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

Sources

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