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

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

InChI
InChI=1S/C17H23BrO5/c1-5-10-22-15(19)17(6-2,7-3)16(20)23-13-9-8-12(18)11-14(13)21-4/h8-9,11H,5-7,10H2,1-4H3
InChI Key
ZAIATAUBFHHZTP-UHFFFAOYSA-N
Formula
C17H23BrO5
SMILES
CCCOC(=O)C(CC)(CC)C(=O)Oc1ccc(Br)cc1OC
Molecular Weight1
387.27
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Physical Properties

Property Value Unit Source
ΔfusH° 40.85 kJ/mol Joback Calculated Property
logPoct/wat 4.123 Crippen Calculated Property
McVol 264.880 ml/mol McGowan Calculated Property
Inp 2274.00 NIST
Tboil 633.93 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 [761.87; 826.23] J/mol×K [826.99; 1041.15] Show Hide
Cp,gas 761.87 J/mol×K 826.99 Joback Calculated Property
Cp,gas 775.51 J/mol×K 862.68 Joback Calculated Property
Cp,gas 787.95 J/mol×K 898.38 Joback Calculated Property
Cp,gas 799.21 J/mol×K 934.07 Joback Calculated Property
Cp,gas 809.33 J/mol×K 969.76 Joback Calculated Property
Cp,gas 818.33 J/mol×K 1005.45 Joback Calculated Property
Cp,gas 826.23 J/mol×K 1041.15 Joback Calculated Property
η [0.0000310; 0.0004012] Pa×s [501.92; 826.99] Show Hide
η 0.0004012 Pa×s 501.92 Joback Calculated Property
η 0.0002127 Pa×s 556.10 Joback Calculated Property
η 0.0001262 Pa×s 610.28 Joback Calculated Property
η 0.0000816 Pa×s 664.46 Joback Calculated Property
η 0.0000563 Pa×s 718.63 Joback Calculated Property
η 0.0000409 Pa×s 772.81 Joback Calculated Property
η 0.0000310 Pa×s 826.99 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 4-bromo-2-methoxyphenyl butyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl isobutyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl ethyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl pentyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl hexyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl undecyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl decyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl tetradecyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl heptyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl octyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl nonyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl dodecyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl propyl ester. Diethylmalonic acid, 2,6-dimethoxyphenyl propyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl 2-methylhex-3-yl ester.

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

Sources

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