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

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

InChI
InChI=1S/C25H39BrO5/c1-5-8-9-10-11-12-13-14-15-18-30-23(27)25(6-2,7-3)24(28)31-21-17-16-20(26)19-22(21)29-4/h16-17,19H,5-15,18H2,1-4H3
InChI Key
HDEUNJPWVYRILL-UHFFFAOYSA-N
Formula
C25H39BrO5
SMILES
CCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc(Br)cc1OC
Molecular Weight1
499.49
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Physical Properties

Property Value Unit Source
ΔfusH° 61.57 kJ/mol Joback Calculated Property
logPoct/wat 7.243 Crippen Calculated Property
McVol 377.600 ml/mol McGowan Calculated Property
Inp [3034.00; 3034.00]   Show Hide
Inp 3034.00 NIST
Inp 3034.00 NIST
Tboil 690.65 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 [1233.87; 1298.50] J/mol×K [1010.03; 1236.56] Show Hide
Cp,gas 1233.87 J/mol×K 1010.03 Joback Calculated Property
Cp,gas 1248.36 J/mol×K 1047.79 Joback Calculated Property
Cp,gas 1261.27 J/mol×K 1085.54 Joback Calculated Property
Cp,gas 1272.68 J/mol×K 1123.30 Joback Calculated Property
Cp,gas 1282.64 J/mol×K 1161.05 Joback Calculated Property
Cp,gas 1291.23 J/mol×K 1198.81 Joback Calculated Property
Cp,gas 1298.50 J/mol×K 1236.56 Joback Calculated Property
η [0.0000084; 0.0001394] Pa×s [592.08; 1010.03] Show Hide
η 0.0001394 Pa×s 592.08 Joback Calculated Property
η 0.0000682 Pa×s 661.74 Joback Calculated Property
η 0.0000382 Pa×s 731.40 Joback Calculated Property
η 0.0000237 Pa×s 801.06 Joback Calculated Property
η 0.0000159 Pa×s 870.71 Joback Calculated Property
η 0.0000113 Pa×s 940.37 Joback Calculated Property
η 0.0000084 Pa×s 1010.03 Joback Calculated Property

Similar Compounds

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

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

Sources

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