Chemical Properties of Benzene, 2,4-dichloro-1-phenoxy- (CAS 51892-26-3)

InChI

InChI=1S/C12H8Cl2O/c13-9-6-7-12(11(14)8-9)15-10-4-2-1-3-5-10/h1-8H

InChI Key

KXIPYLZZJZMMPD-UHFFFAOYSA-N

Formula

C12H8Cl2O

SMILES

Clc1ccc(Oc2ccccc2)c(Cl)c1

Molecular Weight¹

239.10

CAS

51892-26-3

Other Names

• o,p-Dichlorodiphenyl oxide
• 2,4-Dichlorodiphenyl ether
• 2,4-Dichlorophenyl phenyl ether

• 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).
• 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).
• 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 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	[192.85; 430.33]	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			4.05000e+00
Coefficient B			8.17400e-01
Coefficient C			-4.87120e-04
Coefficient D			9.60000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	192.85	J/mol×K	273.00	Calculated Property
Cp,gas	236.51	J/mol×K	353.78	Calculated Property
Cp,gas	275.15	J/mol×K	434.56	Calculated Property
Cp,gas	309.06	J/mol×K	515.33	Calculated Property
Cp,gas	338.55	J/mol×K	596.11	Calculated Property
Cp,gas	363.92	J/mol×K	676.89	Calculated Property
Cp,gas	385.49	J/mol×K	757.67	Calculated Property
Cp,gas	403.54	J/mol×K	838.44	Calculated Property
Cp,gas	418.39	J/mol×K	919.22	Calculated Property
Cp,gas	430.33	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010585; 0.0001655]	Pa×s	[384.95; 623.02]	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			-1.17071e+01
Coefficient B			1.86941e+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.			384.95
Temperature range, max.			623.02
η	0.0010585	Pa×s	384.95	Calculated Property
η	0.0007746	Pa×s	411.40	Calculated Property
η	0.0005887	Pa×s	437.86	Calculated Property
η	0.0004616	Pa×s	464.31	Calculated Property
η	0.0003715	Pa×s	490.76	Calculated Property
η	0.0003058	Pa×s	517.21	Calculated Property
η	0.0002564	Pa×s	543.67	Calculated Property
η	0.0002186	Pa×s	570.12	Calculated Property
η	0.0001890	Pa×s	596.57	Calculated Property
η	0.0001655	Pa×s	623.02	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 2,4-dichloro-1-phenoxy-.

Sources

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

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