Chemical Properties of 1,3-Bis(2-methylphenoxy)-2-propanol

InChI

InChI=1S/C17H20O3/c1-13-7-3-5-9-16(13)19-11-15(18)12-20-17-10-6-4-8-14(17)2/h3-10,15,18H,11-12H2,1-2H3

InChI Key

GZSFOYFMSYYKJH-UHFFFAOYSA-N

Formula

C17H20O3

SMILES

Cc1ccccc1OCC(O)COc1ccccc1C

Molecular Weight¹

272.34

• 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).
• 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).
• 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 Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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	[299.70; 709.45]	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			2.83200e+00
Coefficient B			1.25554e+00
Coefficient C			-6.40920e-04
Coefficient D			9.20000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	299.70	J/mol×K	273.00	Calculated Property
Cp,gas	370.87	J/mol×K	353.78	Calculated Property
Cp,gas	434.95	J/mol×K	434.56	Calculated Property
Cp,gas	492.24	J/mol×K	515.33	Calculated Property
Cp,gas	543.01	J/mol×K	596.11	Calculated Property
Cp,gas	587.57	J/mol×K	676.89	Calculated Property
Cp,gas	626.20	J/mol×K	757.67	Calculated Property
Cp,gas	659.20	J/mol×K	838.44	Calculated Property
Cp,gas	686.85	J/mol×K	919.22	Calculated Property
Cp,gas	709.45	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0006017; 0.0000274]	Pa×s	[449.51; 700.37]	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			-1.60409e+01
Coefficient B			3.87707e+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.			449.51
Temperature range, max.			700.37
η	0.0006017	Pa×s	449.51	Calculated Property
η	0.0003636	Pa×s	477.38	Calculated Property
η	0.0002323	Pa×s	505.26	Calculated Property
η	0.0001555	Pa×s	533.13	Calculated Property
η	0.0001084	Pa×s	561.00	Calculated Property
η	0.0000781	Pa×s	588.88	Calculated Property
η	0.0000580	Pa×s	616.75	Calculated Property
η	0.0000442	Pa×s	644.62	Calculated Property
η	0.0000345	Pa×s	672.50	Calculated Property
η	0.0000274	Pa×s	700.37	Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Bis(2-methylphenoxy)-2-propanol.

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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