Chemical Properties of Succinic acid, heptyl 2,3,5,6-tetrachlorophenyl ester

InChI

InChI=1S/C17H20Cl4O4/c1-2-3-4-5-6-9-24-13(22)7-8-14(23)25-17-15(20)11(18)10-12(19)16(17)21/h10H,2-9H2,1H3

InChI Key

QFMSMTKTEADGMP-UHFFFAOYSA-N

Formula

C17H20Cl4O4

SMILES

CCCCCCCOC(=O)CCC(=O)Oc1c(Cl)c(Cl)cc(Cl)c1Cl

Molecular Weight¹

430.15

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, 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	[405.36; 814.99]	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			1.13108e+02
Coefficient B			1.21952e+00
Coefficient C			-5.56440e-04
Coefficient D			3.88000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	405.36	J/mol×K	273.00	Calculated Property
Cp,gas	476.62	J/mol×K	353.78	Calculated Property
Cp,gas	541.16	J/mol×K	434.56	Calculated Property
Cp,gas	599.10	J/mol×K	515.33	Calculated Property
Cp,gas	650.57	J/mol×K	596.11	Calculated Property
Cp,gas	695.67	J/mol×K	676.89	Calculated Property
Cp,gas	734.54	J/mol×K	757.67	Calculated Property
Cp,gas	767.31	J/mol×K	838.44	Calculated Property
Cp,gas	794.08	J/mol×K	919.22	Calculated Property
Cp,gas	814.99	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0003099; 0.0000625]	Pa×s	[562.19; 781.87]	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			-1.37789e+01
Coefficient B			3.20426e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			562.19
Temperature range, max.			781.87
η	0.0003099	Pa×s	562.19	Calculated Property
η	0.0002445	Pa×s	586.60	Calculated Property
η	0.0001965	Pa×s	611.01	Calculated Property
η	0.0001607	Pa×s	635.42	Calculated Property
η	0.0001333	Pa×s	659.82	Calculated Property
η	0.0001121	Pa×s	684.23	Calculated Property
η	0.0000954	Pa×s	708.64	Calculated Property
η	0.0000821	Pa×s	733.05	Calculated Property
η	0.0000713	Pa×s	757.46	Calculated Property
η	0.0000625	Pa×s	781.87	Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, heptyl 2,3,5,6-tetrachlorophenyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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