Chemical Properties of Dichloroacetic acid, 3,4-dichlorophenyl ester

InChI

InChI=1S/C8H4Cl4O2/c9-5-2-1-4(3-6(5)10)14-8(13)7(11)12/h1-3,7H

InChI Key

VEVXIXJKVRAVCE-UHFFFAOYSA-N

Formula

C8H4Cl4O2

SMILES

O=C(Oc1ccc(Cl)c(Cl)c1)C(Cl)Cl

Molecular Weight¹

273.93

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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 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	[298.72; 337.88]	J/mol×K	[626.78; 868.56]
Cp,gas	298.72	J/mol×K	626.78	Joback Calculated Property
Cp,gas	307.00	J/mol×K	667.08	Joback Calculated Property
Cp,gas	314.57	J/mol×K	707.37	Joback Calculated Property
Cp,gas	321.42	J/mol×K	747.67	Joback Calculated Property
Cp,gas	327.58	J/mol×K	787.96	Joback Calculated Property
Cp,gas	333.06	J/mol×K	828.26	Joback Calculated Property
Cp,gas	337.88	J/mol×K	868.56	Joback Calculated Property
η	[0.0001783; 0.0016211]	Pa×s	[378.39; 626.78]
η	0.0016211	Pa×s	378.39	Joback Calculated Property
η	0.0009360	Pa×s	419.79	Joback Calculated Property
η	0.0005964	Pa×s	461.19	Joback Calculated Property
η	0.0004094	Pa×s	502.58	Joback Calculated Property
η	0.0002975	Pa×s	543.98	Joback Calculated Property
η	0.0002262	Pa×s	585.38	Joback Calculated Property
η	0.0001783	Pa×s	626.78	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dichloroacetic acid, 3,4-dichlorophenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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