Chemical Properties of Ethanol, 2-[4-(1,1-dimethylethyl)phenoxy]-

InChI

InChI=1S/C12H18O2/c1-12(2,3)10-4-6-11(7-5-10)14-9-8-13/h4-7,13H,8-9H2,1-3H3

InChI Key

KGPFHDDLZCYWAO-UHFFFAOYSA-N

Formula

C12H18O2

SMILES

CC(C)(C)c1ccc(OCCO)cc1

Molecular Weight¹

194.27

Other Names

• Ethanol, 2-(p-tert-butylphenoxy)-
• 2-(p-tert-Butylphenoxy)ethanol
• 2-(p-tert-Butylphenyloxy)ethanol
• «beta»-(p-tert-Butylphenoxy)ethanol
• 2-(4-tert-Butylphenoxy)ethanol
• 2-(4-(1,1-Dimethylethyl)phenoxyl)ethanol

• 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).
• I_np : Non-polar retention indices.
• 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, Acentric Factor 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	[231.79; 555.49]	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			-2.13080e+01
Coefficient B			1.10206e+00
Coefficient C			-6.84360e-04
Coefficient D			1.59100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	231.79	J/mol×K	273.00	Calculated Property
Cp,gas	289.97	J/mol×K	353.78	Calculated Property
Cp,gas	341.42	J/mol×K	434.56	Calculated Property
Cp,gas	386.65	J/mol×K	515.33	Calculated Property
Cp,gas	426.16	J/mol×K	596.11	Calculated Property
Cp,gas	460.45	J/mol×K	676.89	Calculated Property
Cp,gas	490.02	J/mol×K	757.67	Calculated Property
Cp,gas	515.39	J/mol×K	838.44	Calculated Property
Cp,gas	537.04	J/mol×K	919.22	Calculated Property
Cp,gas	555.49	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0037828; 0.0000777]	Pa×s	[349.41; 570.29]	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			-1.56077e+01
Coefficient B			3.50474e+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.			349.41
Temperature range, max.			570.29
η	0.0037828	Pa×s	349.41	Calculated Property
η	0.0019585	Pa×s	373.95	Calculated Property
η	0.0010996	Pa×s	398.50	Calculated Property
η	0.0006602	Pa×s	423.04	Calculated Property
η	0.0004191	Pa×s	447.58	Calculated Property
η	0.0002790	Pa×s	472.12	Calculated Property
η	0.0001933	Pa×s	496.67	Calculated Property
η	0.0001387	Pa×s	521.21	Calculated Property
η	0.0001025	Pa×s	545.75	Calculated Property
η	0.0000777	Pa×s	570.29	Calculated Property

Similar Compounds

Find more compounds similar to Ethanol, 2-[4-(1,1-dimethylethyl)phenoxy]-.

Sources

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

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