Chemical Properties of Di-[2-(2-phenylphenoxy) ethyl] ether (CAS 116435-16-6)

InChI

InChI=1S/C28H26O3/c1-3-11-23(12-4-1)25-15-7-9-17-27(25)30-21-19-29-20-22-31-28-18-10-8-16-26(28)24-13-5-2-6-14-24/h1-18H,19-22H2

InChI Key

YGOODJAUVLAERZ-UHFFFAOYSA-N

Formula

C28H26O3

SMILES

c1ccc(-c2ccccc2OCCOCCOc2ccccc2-c2ccccc2)cc1

Molecular Weight¹

410.50

CAS

116435-16-6

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation, 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	[421.75; 1039.19]	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			-5.30860e+01
Coefficient B			2.03960e+00
Coefficient C			-1.15712e-03
Coefficient D			2.09800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	421.75	J/mol×K	273.00	Calculated Property
Cp,gas	532.95	J/mol×K	353.78	Calculated Property
Cp,gas	631.94	J/mol×K	434.56	Calculated Property
Cp,gas	719.41	J/mol×K	515.33	Calculated Property
Cp,gas	796.00	J/mol×K	596.11	Calculated Property
Cp,gas	862.40	J/mol×K	676.89	Calculated Property
Cp,gas	919.25	J/mol×K	757.67	Calculated Property
Cp,gas	967.22	J/mol×K	838.44	Calculated Property
Cp,gas	1006.98	J/mol×K	919.22	Calculated Property
Cp,gas	1039.19	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0001578; 0.0000259]	Pa×s	[602.73; 894.31]	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			-1.43026e+01
Coefficient B			3.34435e+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.			602.73
Temperature range, max.			894.31
η	0.0001578	Pa×s	602.73	Calculated Property
η	0.0001189	Pa×s	635.13	Calculated Property
η	0.0000921	Pa×s	667.53	Calculated Property
η	0.0000730	Pa×s	699.92	Calculated Property
η	0.0000591	Pa×s	732.32	Calculated Property
η	0.0000487	Pa×s	764.72	Calculated Property
η	0.0000408	Pa×s	797.12	Calculated Property
η	0.0000346	Pa×s	829.51	Calculated Property
η	0.0000298	Pa×s	861.91	Calculated Property
η	0.0000259	Pa×s	894.31	Calculated Property

Similar Compounds

Find more compounds similar to Di-[2-(2-phenylphenoxy) ethyl] ether.

Sources

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

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