Chemical Properties of Carbonic acid, 2,2,2-trichloroethyl 3,5-dimethylphenyl ester

InChI

InChI=1S/C11H11Cl3O3/c1-7-3-8(2)5-9(4-7)17-10(15)16-6-11(12,13)14/h3-5H,6H2,1-2H3

InChI Key

FULSZXNBYPXZFY-UHFFFAOYSA-N

Formula

C11H11Cl3O3

SMILES

Cc1cc(C)cc(OC(=O)OCC(Cl)(Cl)Cl)c1

Molecular Weight¹

297.56

• 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	[444.87; 501.04]	J/mol×K	[677.62; 907.50]
Cp,gas	444.87	J/mol×K	677.62	Joback Calculated Property
Cp,gas	456.50	J/mol×K	715.93	Joback Calculated Property
Cp,gas	467.19	J/mol×K	754.25	Joback Calculated Property
Cp,gas	476.96	J/mol×K	792.56	Joback Calculated Property
Cp,gas	485.84	J/mol×K	830.87	Joback Calculated Property
Cp,gas	493.86	J/mol×K	869.19	Joback Calculated Property
Cp,gas	501.04	J/mol×K	907.50	Joback Calculated Property
η	[0.0000964; 0.0009375]	Pa×s	[421.93; 677.62]
η	0.0009375	Pa×s	421.93	Joback Calculated Property
η	0.0005393	Pa×s	464.55	Joback Calculated Property
η	0.0003404	Pa×s	507.16	Joback Calculated Property
η	0.0002308	Pa×s	549.78	Joback Calculated Property
η	0.0001654	Pa×s	592.39	Joback Calculated Property
η	0.0001240	Pa×s	635.00	Joback Calculated Property
η	0.0000964	Pa×s	677.62	Joback Calculated Property

Similar Compounds

Find more compounds similar to Carbonic acid, 2,2,2-trichloroethyl 3,5-dimethylphenyl 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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