Chemical Properties of Di-[2-(4-tert-butyl-2,6-dichlorophenoxy) ethyl] ether

InChI

InChI=1S/C24H30Cl4O3/c1-23(2,3)15-11-17(25)21(18(26)12-15)30-9-7-29-8-10-31-22-19(27)13-16(14-20(22)28)24(4,5)6/h11-14H,7-10H2,1-6H3

InChI Key

NZBZIWDOAAFPSW-UHFFFAOYSA-N

Formula

C24H30Cl4O3

SMILES

CC(C)(C)c1cc(Cl)c(OCCOCCOc2c(Cl)cc(C(C)(C)C)cc2Cl)c(Cl)c1

Molecular Weight¹

508.31

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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	[512.31; 1093.73]	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			7.81740e+01
Coefficient B			1.85832e+00
Coefficient C			-1.03416e-03
Coefficient D			1.91400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	512.31	J/mol×K	273.00	Calculated Property
Cp,gas	614.65	J/mol×K	353.78	Calculated Property
Cp,gas	706.13	J/mol×K	434.56	Calculated Property
Cp,gas	787.38	J/mol×K	515.33	Calculated Property
Cp,gas	859.00	J/mol×K	596.11	Calculated Property
Cp,gas	921.58	J/mol×K	676.89	Calculated Property
Cp,gas	975.74	J/mol×K	757.67	Calculated Property
Cp,gas	1022.08	J/mol×K	838.44	Calculated Property
Cp,gas	1061.21	J/mol×K	919.22	Calculated Property
Cp,gas	1093.73	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000608; 0.0000152]	Pa×s	[679.41; 898.69]	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			-1.53929e+01
Coefficient B			3.86219e+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.			679.41
Temperature range, max.			898.69
η	0.0000608	Pa×s	679.41	Calculated Property
η	0.0000499	Pa×s	703.77	Calculated Property
η	0.0000415	Pa×s	728.14	Calculated Property
η	0.0000350	Pa×s	752.50	Calculated Property
η	0.0000298	Pa×s	776.87	Calculated Property
η	0.0000256	Pa×s	801.23	Calculated Property
η	0.0000222	Pa×s	825.59	Calculated Property
η	0.0000194	Pa×s	849.96	Calculated Property
η	0.0000171	Pa×s	874.32	Calculated Property
η	0.0000152	Pa×s	898.69	Calculated Property

Similar Compounds

Find more compounds similar to Di-[2-(4-tert-butyl-2,6-dichlorophenoxy) ethyl] ether.

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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