Chemical Properties of Ether, isopentyl phenyl (CAS 1129-64-2)

InChI

InChI=1S/C11H16O/c1-10(2)8-9-12-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3

InChI Key

ZSBTVXBAENDZBH-UHFFFAOYSA-N

Formula

C11H16O

SMILES

CC(C)CCOc1ccccc1

Molecular Weight¹

164.24

CAS

1129-64-2

• 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	[196.67; 487.34]	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			-1.71980e+01
Coefficient B			9.12640e-01
Coefficient C			-4.98000e-04
Coefficient D			8.99000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	196.67	J/mol×K	273.00	Calculated Property
Cp,gas	247.33	J/mol×K	353.78	Calculated Property
Cp,gas	292.73	J/mol×K	434.56	Calculated Property
Cp,gas	333.17	J/mol×K	515.33	Calculated Property
Cp,gas	368.92	J/mol×K	596.11	Calculated Property
Cp,gas	400.27	J/mol×K	676.89	Calculated Property
Cp,gas	427.50	J/mol×K	757.67	Calculated Property
Cp,gas	450.90	J/mol×K	838.44	Calculated Property
Cp,gas	470.75	J/mol×K	919.22	Calculated Property
Cp,gas	487.34	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0040450; 0.0001816]	Pa×s	[247.38; 493.44]	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			-1.17336e+01
Coefficient B			1.53953e+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.			247.38
Temperature range, max.			493.44
η	0.0040450	Pa×s	247.38	Calculated Property
η	0.0021774	Pa×s	274.72	Calculated Property
η	0.0013112	Pa×s	302.06	Calculated Property
η	0.0008589	Pa×s	329.40	Calculated Property
η	0.0006003	Pa×s	356.74	Calculated Property
η	0.0004415	Pa×s	384.08	Calculated Property
η	0.0003383	Pa×s	411.42	Calculated Property
η	0.0002679	Pa×s	438.76	Calculated Property
η	0.0002181	Pa×s	466.10	Calculated Property
η	0.0001816	Pa×s	493.44	Calculated Property

Similar Compounds

Find more compounds similar to Ether, isopentyl phenyl.

Sources

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

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