Chemical Properties of Cyclopropanecarboxylic acid, 2,3,4,6-tetrachlorophenyl ester

InChI

InChI=1S/C10H6Cl4O2/c11-5-3-6(12)9(8(14)7(5)13)16-10(15)4-1-2-4/h3-4H,1-2H2

InChI Key

SCFFYKVQJXROAN-UHFFFAOYSA-N

Formula

C10H6Cl4O2

SMILES

O=C(Oc1c(Cl)cc(Cl)c(Cl)c1Cl)C1CC1

Molecular Weight¹

299.96

• 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[217.08; 425.48]	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			4.38200e+01
Coefficient B			7.60200e-01
Coefficient C			-4.90440e-04
Coefficient D			1.11900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	217.08	J/mol×K	273.00	Calculated Property
Cp,gas	256.33	J/mol×K	353.78	Calculated Property
Cp,gas	290.74	J/mol×K	434.56	Calculated Property
Cp,gas	320.65	J/mol×K	515.33	Calculated Property
Cp,gas	346.41	J/mol×K	596.11	Calculated Property
Cp,gas	368.39	J/mol×K	676.89	Calculated Property
Cp,gas	386.93	J/mol×K	757.67	Calculated Property
Cp,gas	402.39	J/mol×K	838.44	Calculated Property
Cp,gas	415.12	J/mol×K	919.22	Calculated Property
Cp,gas	425.48	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013142; 0.0004526]	Pa×s	[458.91; 654.06]	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			-1.02073e+01
Coefficient B			1.63958e+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.			458.91
Temperature range, max.			654.06
η	0.0013142	Pa×s	458.91	Calculated Property
η	0.0011185	Pa×s	480.59	Calculated Property
η	0.0009653	Pa×s	502.28	Calculated Property
η	0.0008434	Pa×s	523.96	Calculated Property
η	0.0007448	Pa×s	545.64	Calculated Property
η	0.0006640	Pa×s	567.32	Calculated Property
η	0.0005969	Pa×s	589.01	Calculated Property
η	0.0005408	Pa×s	610.69	Calculated Property
η	0.0004932	Pa×s	632.37	Calculated Property
η	0.0004526	Pa×s	654.06	Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, 2,3,4,6-tetrachlorophenyl 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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