Chemical Properties of Succinic acid, di(2-(2-chlorophenoxy)ethyl) ester

InChI

InChI=1S/C20H20Cl2O6/c21-15-5-1-3-7-17(15)25-11-13-27-19(23)9-10-20(24)28-14-12-26-18-8-4-2-6-16(18)22/h1-8H,9-14H2

InChI Key

QNKNESZJDWBOEA-UHFFFAOYSA-N

Formula

C20H20Cl2O6

SMILES

O=C(CCC(=O)OCCOc1ccccc1Cl)OCCOc1ccccc1Cl

Molecular Weight¹

427.27

• 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

Property	Value	Unit	Source
ΔfusH°	54.37	kJ/mol	Joback Calculated Property
IE	8.38	eV	Relay (1.0) Calculated Property
log10WS	-5.36		Relay (1.0) Calculated Property
logPoct/wat	4.318		Crippen Calculated Property
McVol	296.240	ml/mol	McGowan Calculated Property
Inp	[3223.00; 3223.00]
Inp	3223.00		NIST
Inp	3223.00		NIST
Tfus	367.43	K	Relay (1.0) Calculated Property

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	[410.64; 877.78]	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			7.30960e+01
Coefficient B			1.40460e+00
Coefficient C			-6.22120e-04
Coefficient D			2.22000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	410.64	J/mol×K	273.00	Calculated Property
Cp,gas	493.13	J/mol×K	353.78	Calculated Property
Cp,gas	567.81	J/mol×K	434.56	Calculated Property
Cp,gas	634.76	J/mol×K	515.33	Calculated Property
Cp,gas	694.03	J/mol×K	596.11	Calculated Property
Cp,gas	745.70	J/mol×K	676.89	Calculated Property
Cp,gas	789.84	J/mol×K	757.67	Calculated Property
Cp,gas	826.52	J/mol×K	838.44	Calculated Property
Cp,gas	855.81	J/mol×K	919.22	Calculated Property
Cp,gas	877.78	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001872; 0.0000308]	Pa×s	[582.00; 829.11]	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			-1.46386e+01
Coefficient B			3.52422e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			582.00
Temperature range, max.			829.11
η	0.0001872	Pa×s	582.00	Calculated Property
η	0.0001425	Pa×s	609.46	Calculated Property
η	0.0001111	Pa×s	636.91	Calculated Property
η	0.0000884	Pa×s	664.37	Calculated Property
η	0.0000716	Pa×s	691.83	Calculated Property
η	0.0000589	Pa×s	719.28	Calculated Property
η	0.0000492	Pa×s	746.74	Calculated Property
η	0.0000416	Pa×s	774.20	Calculated Property
η	0.0000356	Pa×s	801.65	Calculated Property
η	0.0000308	Pa×s	829.11	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(2-(2-chlorophenoxy)ethyl) 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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