Chemical Properties of 4-(2,4-Dichlorophenoxy)butyl 2,2,3-trichloropropanoate

InChI

InChI=1S/C13H13Cl5O3/c14-8-13(17,18)12(19)21-6-2-1-5-20-11-4-3-9(15)7-10(11)16/h3-4,7H,1-2,5-6,8H2

InChI Key

BGPDOPQNJMHBIX-UHFFFAOYSA-N

Formula

C13H13Cl5O3

SMILES

O=C(OCCCCOc1ccc(Cl)cc1Cl)C(Cl)(Cl)CCl

Molecular Weight¹

394.51

• 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).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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 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	[593.15; 641.47]	J/mol×K	[816.11; 1045.20]
Cp,gas	593.15	J/mol×K	816.11	Joback Calculated Property
Cp,gas	603.35	J/mol×K	854.29	Joback Calculated Property
Cp,gas	612.64	J/mol×K	892.47	Joback Calculated Property
Cp,gas	621.06	J/mol×K	930.65	Joback Calculated Property
Cp,gas	628.64	J/mol×K	968.83	Joback Calculated Property
Cp,gas	635.43	J/mol×K	1007.01	Joback Calculated Property
Cp,gas	641.47	J/mol×K	1045.20	Joback Calculated Property
η	[0.0000593; 0.0004270]	Pa×s	[534.14; 816.11]
η	0.0004270	Pa×s	534.14	Joback Calculated Property
η	0.0002690	Pa×s	581.13	Joback Calculated Property
η	0.0001815	Pa×s	628.13	Joback Calculated Property
η	0.0001294	Pa×s	675.12	Joback Calculated Property
η	0.0000964	Pa×s	722.12	Joback Calculated Property
η	0.0000745	Pa×s	769.12	Joback Calculated Property
η	0.0000593	Pa×s	816.11	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-(2,4-Dichlorophenoxy)butyl 2,2,3-trichloropropanoate.

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

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.
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