Chemical Properties of 2-(4-Chlorophenoxy)tetrahydro-2h-pyran

InChI

InChI=1S/C11H13ClO2/c12-9-4-6-10(7-5-9)14-11-3-1-2-8-13-11/h4-7,11H,1-3,8H2

InChI Key

BATPOJJUDDURGW-UHFFFAOYSA-N

Formula

C11H13ClO2

SMILES

Clc1ccc(OC2CCCCO2)cc1

Molecular Weight¹

212.68

• 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).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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	[192.18; 496.63]	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			-3.66100e+01
Coefficient B			9.73100e-01
Coefficient C			-5.15260e-04
Coefficient D			7.54000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	192.18	J/mol×K	273.00	Calculated Property
Cp,gas	246.50	J/mol×K	353.78	Calculated Property
Cp,gas	295.14	J/mol×K	434.56	Calculated Property
Cp,gas	338.34	J/mol×K	515.33	Calculated Property
Cp,gas	376.34	J/mol×K	596.11	Calculated Property
Cp,gas	409.37	J/mol×K	676.89	Calculated Property
Cp,gas	437.68	J/mol×K	757.67	Calculated Property
Cp,gas	461.50	J/mol×K	838.44	Calculated Property
Cp,gas	481.07	J/mol×K	919.22	Calculated Property
Cp,gas	496.63	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0022508; 0.0001955]	Pa×s	[338.77; 583.69]	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			-1.19202e+01
Coefficient B			1.97291e+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.			338.77
Temperature range, max.			583.69
η	0.0022508	Pa×s	338.77	Calculated Property
η	0.0014597	Pa×s	365.98	Calculated Property
η	0.0010052	Pa×s	393.20	Calculated Property
η	0.0007264	Pa×s	420.41	Calculated Property
η	0.0005461	Pa×s	447.62	Calculated Property
η	0.0004242	Pa×s	474.84	Calculated Property
η	0.0003387	Pa×s	502.05	Calculated Property
η	0.0002767	Pa×s	529.26	Calculated Property
η	0.0002306	Pa×s	556.48	Calculated Property
η	0.0001955	Pa×s	583.69	Calculated Property

Similar Compounds

Find more compounds similar to 2-(4-Chlorophenoxy)tetrahydro-2h-pyran.

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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