Chemical Properties of Succinic acid, di(2,4-dichlorophenethyl) ester

InChI

InChI=1S/C20H18Cl4O4/c21-15-3-1-13(17(23)11-15)7-9-27-19(25)5-6-20(26)28-10-8-14-2-4-16(22)12-18(14)24/h1-4,11-12H,5-10H2

InChI Key

HQLVMINBXCVZDE-UHFFFAOYSA-N

Formula

C20H18Cl4O4

SMILES

O=C(CCC(=O)OCCc1ccc(Cl)cc1Cl)OCCc1ccc(Cl)cc1Cl

Molecular Weight¹

464.17

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

Physical Properties

Property	Value	Unit	Source
ΔfusH°	59.61	kJ/mol	Joback Calculated Property
log10WS	-6.93		Relay (1.0) Calculated Property
logPoct/wat	5.952		Crippen Calculated Property
McVol	308.980	ml/mol	McGowan Calculated Property
Inp	[3246.00; 3246.00]
Inp	3246.00		NIST
Inp	3246.00		NIST
Tboil	699.10	K	Relay (1.0) Calculated Property
Tfus	353.30	K	Relay (1.0) Calculated Property

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, 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	[411.74; 851.24]	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			7.64760e+01
Coefficient B			1.42560e+00
Coefficient C			-7.50840e-04
Coefficient D			1.00000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	411.74	J/mol×K	273.00	Calculated Property
Cp,gas	491.28	J/mol×K	353.78	Calculated Property
Cp,gas	562.40	J/mol×K	434.56	Calculated Property
Cp,gas	625.42	J/mol×K	515.33	Calculated Property
Cp,gas	680.66	J/mol×K	596.11	Calculated Property
Cp,gas	728.44	J/mol×K	676.89	Calculated Property
Cp,gas	769.07	J/mol×K	757.67	Calculated Property
Cp,gas	802.87	J/mol×K	838.44	Calculated Property
Cp,gas	830.15	J/mol×K	919.22	Calculated Property
Cp,gas	851.24	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001978; 0.0000407]	Pa×s	[622.42; 863.84]	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			-1.41837e+01
Coefficient B			3.52016e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			622.42
Temperature range, max.			863.84
η	0.0001978	Pa×s	622.42	Calculated Property
η	0.0001566	Pa×s	649.24	Calculated Property
η	0.0001263	Pa×s	676.07	Calculated Property
η	0.0001035	Pa×s	702.89	Calculated Property
η	0.0000861	Pa×s	729.72	Calculated Property
η	0.0000726	Pa×s	756.54	Calculated Property
η	0.0000619	Pa×s	783.37	Calculated Property
η	0.0000533	Pa×s	810.19	Calculated Property
η	0.0000464	Pa×s	837.02	Calculated Property
η	0.0000407	Pa×s	863.84	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, di(2,4-dichlorophenethyl) 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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