TY - JOUR
T1 - Experimental Determination and Modeling Thermophysical Properties of 1-Chlorononane in a Wide Range of Conditions
T2 - Is It Possible to Predict a Contribution of Chlorine Atom?
AU - Melent'Ev, Vyacheslav V.
AU - Postnikov, Eugene B.
AU - Polishuk, Ilya
N1 - Publisher Copyright:
© 2018 American Chemical Society.
PY - 2018/4/11
Y1 - 2018/4/11
N2 - This study reports the experimental density and speed of sound data of 1-chlorononane along seven isotherms from 293.15 to 413.15 K at pressures from saturation up to 196.1 MPa. The pertinent isothermal compressibility and isobaric coefficient of expansion data have been obtained by numerical differentiating of densities. In addition, the saturated liquid densities have been measured from 253.15 to 443.15 K, isobaric heat capacities from 248.15 to 448.15 K, and speeds of sound from 246.88 to 457.25 K. These results have been interpolated by polynomials to obtain the saturated liquid isobaric coefficient of expansion, adiabatic and isothermal compressibility, isochoric heat capacity, and internal pressure data. Performances of three predictive approaches having different degrees of complexity, namely the Critical Point-based Perturbed Chain Statistical Association Fluid Theory, the Statistical Association Fluid Theory of Variable Range Mie Potential parametrized by a Corresponding States approach of Mejía et al. (Ind. Eng. Chem. Res. 2014, 53, 4131), and the fluctuation theory-based Tait-like equation of state have been examined. The latter model has a superiority in estimating of the high-pressure data; however, unlike both statistical association fluid theory approaches, it utilizes the saturated liquid data. It has also been demonstrated that all the models successfully predict various phenomena related with replacement of hydrogen by chlorine in n-nonane molecule.
AB - This study reports the experimental density and speed of sound data of 1-chlorononane along seven isotherms from 293.15 to 413.15 K at pressures from saturation up to 196.1 MPa. The pertinent isothermal compressibility and isobaric coefficient of expansion data have been obtained by numerical differentiating of densities. In addition, the saturated liquid densities have been measured from 253.15 to 443.15 K, isobaric heat capacities from 248.15 to 448.15 K, and speeds of sound from 246.88 to 457.25 K. These results have been interpolated by polynomials to obtain the saturated liquid isobaric coefficient of expansion, adiabatic and isothermal compressibility, isochoric heat capacity, and internal pressure data. Performances of three predictive approaches having different degrees of complexity, namely the Critical Point-based Perturbed Chain Statistical Association Fluid Theory, the Statistical Association Fluid Theory of Variable Range Mie Potential parametrized by a Corresponding States approach of Mejía et al. (Ind. Eng. Chem. Res. 2014, 53, 4131), and the fluctuation theory-based Tait-like equation of state have been examined. The latter model has a superiority in estimating of the high-pressure data; however, unlike both statistical association fluid theory approaches, it utilizes the saturated liquid data. It has also been demonstrated that all the models successfully predict various phenomena related with replacement of hydrogen by chlorine in n-nonane molecule.
UR - http://www.scopus.com/inward/record.url?scp=85045378618&partnerID=8YFLogxK
U2 - 10.1021/acs.iecr.8b00174
DO - 10.1021/acs.iecr.8b00174
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AN - SCOPUS:85045378618
SN - 0888-5885
VL - 57
SP - 5142
EP - 5150
JO - Industrial and Engineering Chemistry Research
JF - Industrial and Engineering Chemistry Research
IS - 14
ER -