ABSTRACT

Experimental solubilities are reported for phenanthrene dissolved in binary solvent mixtures of methanol + ethanol, methanol + 2-propanol, ethanol + 2-propanol, 1- propanol + 2-propanol, and 1-butanol + 2-propanol at 298.15 K. Results of these measurements were used to evaluate the prediction capability of previously developed quantitative structure-property relationships employing the solubility data in monosolvents and the overall mean deviations (OMDs) of the models varied between (1.1 to 24.2) %. Using ab initio prediction methods the OMDs varied between (7.0 to 114.7) %.

Compounds

#	Formula	Name
1	C14H10	phenanthrene
2	CH4O	methanol
3	C2H6O	ethanol
4	C3H8O	propan-1-ol
5	C3H8O	propan-2-ol
6	C4H10O	butan-1-ol

Datasets

The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type	Compound-#	Property	Variable	Constraint	Phase	Method	#Points
POMD	1	Normal melting temperature, K ; Crystal			Crystal Liquid Air at 1 atmosphere	DTA	1
POMD	3 2 1	Amount concentration (molarity), mol/dm3 - 1 ; Liquid	Solvent: Mole fraction - 3; Liquid	Pressure, kPa; Liquid Temperature, K; Liquid	Liquid Crystal - 1	SPECTR	11
POMD	3 2 1	Mass density, kg/m3 ; Liquid	Solvent: Mole fraction - 3; Liquid	Temperature, K; Liquid Pressure, kPa; Liquid	Liquid Crystal - 1	PYCNOM:UFactor:8	11
POMD	2 5 1	Amount concentration (molarity), mol/dm3 - 1 ; Liquid	Solvent: Mole fraction - 2; Liquid	Pressure, kPa; Liquid Temperature, K; Liquid	Liquid Crystal - 1	SPECTR	11
POMD	2 5 1	Mass density, kg/m3 ; Liquid	Solvent: Mole fraction - 2; Liquid	Temperature, K; Liquid Pressure, kPa; Liquid	Liquid Crystal - 1	PYCNOM:UFactor:8	11
POMD	3 5 1	Amount concentration (molarity), mol/dm3 - 1 ; Liquid	Solvent: Mole fraction - 3; Liquid	Pressure, kPa; Liquid Temperature, K; Liquid	Liquid Crystal - 1	SPECTR	11
POMD	3 5 1	Mass density, kg/m3 ; Liquid	Solvent: Mole fraction - 3; Liquid	Temperature, K; Liquid Pressure, kPa; Liquid	Liquid Crystal - 1	PYCNOM:UFactor:8	11
POMD	5 4 1	Amount concentration (molarity), mol/dm3 - 1 ; Liquid	Solvent: Mole fraction - 4; Liquid	Pressure, kPa; Liquid Temperature, K; Liquid	Liquid Crystal - 1	SPECTR	11
POMD	5 4 1	Mass density, kg/m3 ; Liquid	Solvent: Mole fraction - 4; Liquid	Temperature, K; Liquid Pressure, kPa; Liquid	Liquid Crystal - 1	PYCNOM:UFactor:8	11
POMD	5 6 1	Amount concentration (molarity), mol/dm3 - 1 ; Liquid	Solvent: Mole fraction - 6; Liquid	Pressure, kPa; Liquid Temperature, K; Liquid	Liquid Crystal - 1	SPECTR	11
POMD	5 6 1	Mass density, kg/m3 ; Liquid	Solvent: Mole fraction - 6; Liquid	Temperature, K; Liquid Pressure, kPa; Liquid	Liquid Crystal - 1	PYCNOM:UFactor:8	11

Thermodynamics Research Center / ThermoML | Journal of Chemical and Engineering Data

Solubility of Phenanthrene in Binary Mixtures of C1-C4 Alcohols + 2-Propanol and Ethanol + Methanol at 298.15 K

Fakhree, M.[Mohammad], Shayanfar, A.[Ali], Acree, Jr., W. E.[William E.], Jouyban, A.[Abolghasem]

ABSTRACT