Chemical Properties of Myristic acid, 3,4-dichlorophenyl ester

InChI

InChI=1S/C20H30Cl2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-20(23)24-17-14-15-18(21)19(22)16-17/h14-16H,2-13H2,1H3

InChI Key

UGDWGXYFBAYMQX-UHFFFAOYSA-N

Formula

C20H30Cl2O2

SMILES

CCCCCCCCCCCCCC(=O)Oc1ccc(Cl)c(Cl)c1

Molecular Weight¹

373.36

• 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	[420.75; 951.19]	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			3.05920e+01
Coefficient B			1.66472e+00
Coefficient C			-9.07520e-04
Coefficient D			1.63400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	420.75	J/mol×K	273.00	Calculated Property
Cp,gas	513.18	J/mol×K	353.78	Calculated Property
Cp,gas	596.04	J/mol×K	434.56	Calculated Property
Cp,gas	669.83	J/mol×K	515.33	Calculated Property
Cp,gas	735.08	J/mol×K	596.11	Calculated Property
Cp,gas	792.29	J/mol×K	676.89	Calculated Property
Cp,gas	842.00	J/mol×K	757.67	Calculated Property
Cp,gas	884.70	J/mol×K	838.44	Calculated Property
Cp,gas	920.93	J/mol×K	919.22	Calculated Property
Cp,gas	951.19	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007058; 0.0000849]	Pa×s	[468.79; 718.36]	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			-1.33504e+01
Coefficient B			2.85690e+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.			468.79
Temperature range, max.			718.36
η	0.0007058	Pa×s	468.79	Calculated Property
η	0.0005022	Pa×s	496.52	Calculated Property
η	0.0003704	Pa×s	524.25	Calculated Property
η	0.0002817	Pa×s	551.98	Calculated Property
η	0.0002199	Pa×s	579.71	Calculated Property
η	0.0001756	Pa×s	607.44	Calculated Property
η	0.0001430	Pa×s	635.17	Calculated Property
η	0.0001185	Pa×s	662.90	Calculated Property
η	0.0000997	Pa×s	690.63	Calculated Property
η	0.0000849	Pa×s	718.36	Calculated Property

Similar Compounds

Find more compounds similar to Myristic acid, 3,4-dichlorophenyl ester.

Sources

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

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