Chemical Properties of Dimethylmalonic acid, 2-bromo-4-fluorophenyl octyl ester

Dimethylmalonic acid, 2-bromo-4-fluorophenyl octyl ester

InChI
InChI=1S/C19H26BrFO4/c1-4-5-6-7-8-9-12-24-17(22)19(2,3)18(23)25-16-11-10-14(21)13-15(16)20/h10-11,13H,4-9,12H2,1-3H3
InChI Key
HUWZDMYHBAGNBK-UHFFFAOYSA-N
Formula
C19H26BrFO4
SMILES
CCCCCCCCOC(=O)C(C)(C)C(=O)Oc1ccc(F)cc1Br
Molecular Weight1
417.31
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Physical Properties

Property Value Unit Source
ΔfusH° 44.75 kJ/mol Joback Calculated Property
logPoct/wat 5.423 Crippen Calculated Property
McVol 288.960 ml/mol McGowan Calculated Property
Inp [2299.00; 2299.00]   Show Hide
Inp 2299.00 NIST
Inp 2299.00 NIST
Tboil 621.11 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 [866.41; 934.70] J/mol×K [885.54; 1097.51] Show Hide
Cp,gas 866.41 J/mol×K 885.54 Joback Calculated Property
Cp,gas 880.29 J/mol×K 920.87 Joback Calculated Property
Cp,gas 893.11 J/mol×K 956.20 Joback Calculated Property
Cp,gas 904.91 J/mol×K 991.52 Joback Calculated Property
Cp,gas 915.75 J/mol×K 1026.85 Joback Calculated Property
Cp,gas 925.66 J/mol×K 1062.18 Joback Calculated Property
Cp,gas 934.70 J/mol×K 1097.51 Joback Calculated Property

Similar Compounds

Dimethylmalonic acid, 2-bromo-4-fluorophenyl nonyl ester. Dimethylmalonic acid, 2-bromo-4-fluorophenyl heptyl ester. Dimethylmalonic acid, 2-bromo-4-fluorophenyl pentyl ester. Dimethylmalonic acid, 2-bromo-4-fluorophenyl butyl ester. Dimethylmalonic acid, 2-bromo-4-fluorophenyl isohexyl ester. Dimethylmalonic acid, 2-bromo-4-fluorophenyl propyl ester. Dimethylmalonic acid, 2-bromo-4-fluorophenyl isobutyl ester. Sebacic acid, 2-bromo-4-fluorophenyl dodecyl ester. Sebacic acid, 2-bromo-4-fluorophenyl decyl ester. Sebacic acid, 2-bromo-4-fluorophenyl hexyl ester. Sebacic acid, 2-bromo-4-fluorophenyl nonyl ester. Sebacic acid, 2-bromo-4-fluorophenyl octyl ester. Sebacic acid, 2-bromo-4-fluorophenyl heptyl ester. Sebacic acid, 2-bromo-4-fluorophenyl undecyl ester. Sebacic acid, 2-bromo-4-fluorophenyl pentyl ester.

Find more compounds similar to Dimethylmalonic acid, 2-bromo-4-fluorophenyl octyl ester.

Sources

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