Chemical Properties of Cyclopropanecarboxylic acid, 2,4,5-trichlorophenyl ester

InChI

InChI=1S/C10H7Cl3O2/c11-6-3-8(13)9(4-7(6)12)15-10(14)5-1-2-5/h3-5H,1-2H2

InChI Key

JTXKTAJEYVQEMR-UHFFFAOYSA-N

Formula

C10H7Cl3O2

SMILES

O=C(Oc1cc(Cl)c(Cl)cc1Cl)C1CC1

Molecular Weight¹

265.52

• 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.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[201.12; 420.25]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.66300e+01
Coefficient B			8.12900e-01
Coefficient C			-5.37080e-04
Coefficient D			1.27800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	201.12	J/mol×K	273.00	Calculated Property
Cp,gas	242.65	J/mol×K	353.78	Calculated Property
Cp,gas	278.95	J/mol×K	434.56	Calculated Property
Cp,gas	310.40	J/mol×K	515.33	Calculated Property
Cp,gas	337.43	J/mol×K	596.11	Calculated Property
Cp,gas	360.43	J/mol×K	676.89	Calculated Property
Cp,gas	379.81	J/mol×K	757.67	Calculated Property
Cp,gas	395.97	J/mol×K	838.44	Calculated Property
Cp,gas	409.31	J/mol×K	919.22	Calculated Property
Cp,gas	420.25	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015327; 0.0004592]	Pa×s	[416.47; 621.92]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.01293e+01
Coefficient B			1.51952e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			416.47
Temperature range, max.			621.92
η	0.0015327	Pa×s	416.47	Calculated Property
η	0.0012680	Pa×s	439.30	Calculated Property
η	0.0010688	Pa×s	462.12	Calculated Property
η	0.0009156	Pa×s	484.95	Calculated Property
η	0.0007953	Pa×s	507.78	Calculated Property
η	0.0006992	Pa×s	530.61	Calculated Property
η	0.0006213	Pa×s	553.43	Calculated Property
η	0.0005573	Pa×s	576.26	Calculated Property
η	0.0005040	Pa×s	599.09	Calculated Property
η	0.0004592	Pa×s	621.92	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, 2,4,5-trichlorophenyl 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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