Chemical Properties of Succinic acid, 2-chlorophenyl 2-chloroethyl ester

InChI

InChI=1S/C12H12Cl2O4/c13-7-8-17-11(15)5-6-12(16)18-10-4-2-1-3-9(10)14/h1-4H,5-8H2

InChI Key

HMFXHQHRCNNEOF-UHFFFAOYSA-N

Formula

C12H12Cl2O4

SMILES

O=C(CCC(=O)Oc1ccccc1Cl)OCCCl

Molecular Weight¹

291.13

• 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).
• 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 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	[264.83; 549.61]	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			4.89740e+01
Coefficient B			9.09400e-01
Coefficient C			-4.44760e-04
Coefficient D			3.60000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	264.83	J/mol×K	273.00	Calculated Property
Cp,gas	316.63	J/mol×K	353.78	Calculated Property
Cp,gas	363.13	J/mol×K	434.56	Calculated Property
Cp,gas	404.43	J/mol×K	515.33	Calculated Property
Cp,gas	440.66	J/mol×K	596.11	Calculated Property
Cp,gas	471.92	J/mol×K	676.89	Calculated Property
Cp,gas	498.34	J/mol×K	757.67	Calculated Property
Cp,gas	520.01	J/mol×K	838.44	Calculated Property
Cp,gas	537.07	J/mol×K	919.22	Calculated Property
Cp,gas	549.61	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013094; 0.0001390]	Pa×s	[408.44; 638.15]	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			-1.28682e+01
Coefficient B			2.54460e+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.			408.44
Temperature range, max.			638.15
η	0.0013094	Pa×s	408.44	Calculated Property
η	0.0009077	Pa×s	433.96	Calculated Property
η	0.0006554	Pa×s	459.49	Calculated Property
η	0.0004897	Pa×s	485.01	Calculated Property
η	0.0003767	Pa×s	510.53	Calculated Property
η	0.0002971	Pa×s	536.06	Calculated Property
η	0.0002395	Pa×s	561.58	Calculated Property
η	0.0001967	Pa×s	587.10	Calculated Property
η	0.0001642	Pa×s	612.63	Calculated Property
η	0.0001390	Pa×s	638.15	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-chlorophenyl 2-chloroethyl 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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