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

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

InChI
InChI=1S/C23H35BrO5/c1-5-8-9-10-11-12-13-16-28-21(25)23(6-2,7-3)22(26)29-19-15-14-18(24)17-20(19)27-4/h14-15,17H,5-13,16H2,1-4H3
InChI Key
NIPXWOGZCVTIDX-UHFFFAOYSA-N
Formula
C23H35BrO5
SMILES
CCCCCCCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc(Br)cc1OC
Molecular Weight1
471.43
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 56.39 kJ/mol Joback Calculated Property
logPoct/wat 6.463 Crippen Calculated Property
McVol 349.420 ml/mol McGowan Calculated Property
Inp 2822.00 NIST
Tboil 676.73 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 [1112.55; 1177.61] J/mol×K [964.27; 1182.48] Show Hide
Cp,gas 1112.55 J/mol×K 964.27 Joback Calculated Property
Cp,gas 1126.81 J/mol×K 1000.64 Joback Calculated Property
Cp,gas 1139.63 J/mol×K 1037.01 Joback Calculated Property
Cp,gas 1151.07 J/mol×K 1073.37 Joback Calculated Property
Cp,gas 1161.18 J/mol×K 1109.74 Joback Calculated Property
Cp,gas 1170.01 J/mol×K 1146.11 Joback Calculated Property
Cp,gas 1177.61 J/mol×K 1182.48 Joback Calculated Property
η [0.0000117; 0.0001842] Pa×s [569.54; 964.27] Show Hide
η 0.0001842 Pa×s 569.54 Joback Calculated Property
η 0.0000917 Pa×s 635.33 Joback Calculated Property
η 0.0000521 Pa×s 701.12 Joback Calculated Property
η 0.0000326 Pa×s 766.90 Joback Calculated Property
η 0.0000219 Pa×s 832.69 Joback Calculated Property
η 0.0000157 Pa×s 898.48 Joback Calculated Property
η 0.0000117 Pa×s 964.27 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 octyl ester. Diethylmalonic acid, 4-bromo-2-methoxyphenyl undecyl 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 nonyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.