Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Thermophysical study of 2-acetylthiophene: Experimental and modelled results

Anton, V., Artigas, H., Munoz-Embid, J., Artal, M., Lafuente, C.
Fluid Phase Equilib. 2017, 433, 126-134
ABSTRACT
Several thermophysical properties have been studied for 2-acetylthiophene: (i) vapour pressure was determined at temperatures within 336.16 - 445.02 K; (ii) density, speed of sound, static permittivity, refractive index, surface tension, and kinematic viscosity were measured at p = 0.1 MPa and at temperatures from 278.15 K (or 283.15 K for the refractive index) to 338.15 K; (iii) volumetric properties were also determined at temperatures in the (283.15 - 338.15) K range and at pressures up to 65.0 MPa. From these experimental values, different derivative properties have been calculated such as enthalpy of vaporization, isobaric expansibility, isothermal and isentropic compressibility, dipole moment, entropy and enthalpy of surface formation, and dynamic viscosity. All experimental properties were correlated and the results were explained through the intermolecular interactions. Moreover PC-SAFT EoS was used to model the thermodynamic behaviour of the compound. Finally, this EoS combined with the Density Gradient Theory allowed obtaining the influence parameter for the surface tension of 2-acetylthiophene.
Compounds
# Formula Name
1 C6H6OS 2-acetylthiophene
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
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 184
  • POMD
  • 1
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 25
  • POMD
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Frequency, MHz; Liquid
  • Liquid
  • Sing-around technique in a fixed-path interferometer
  • 25
  • POMD
  • 1
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 23
  • POMD
  • 1
  • Relative permittivity at zero frequency ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • capacitive
  • 25
  • POMD
  • 1
  • Kinematic viscosity, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Capillary tube (Ostwald; Ubbelohde) method
  • 25
  • POMD
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 27
  • POMD
  • 1
  • Surface tension liquid-gas, N/m ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Air at 1 atmosphere
  • Drop volume
  • 25