IUPAC-NIST Solubility Database
NIST Standard Reference Database 106


Glass Ball as Bullet Solubility System: Acetonitrile with Butane

Components:
   (1) Acetonitrile; C2H3N; [75-05-8]  NIST Chemistry WebBook for detail
   (2) Butane; C4H10; [106-97-8]  NIST Chemistry WebBook for detail

Evaluator:
   Valerii P. Sazonov, Technical University, Samara, Russia, August, 2001

Critical Evaluation:

           Solubilities in the system comprising acetonitrile and butane have been reported in three publications.

        Pavlov et al.1 determined the mutual solubilities of acetonitrile and butane between 276 and 335 K for unknown pressure by the synthetic method and these data were presented in graphical form only. Gruszkiewicz et al.2 measured the mutual solubilities of (1) and (2) between 298 and 334 K and pressure 5 to 10 MPa using the synthetic method and reported their results only in the form of an equation. Warowny3 studied the phase equilibrium of the liquid-liquid-gas system and the mutual solubility of (1) and (2) between 319 and 336 K and over the pressure range 0.45 to 0.68 MPa by the synthetic method.

        The upper critical solution temperature has been reported as 333.59 K2 (at 5 MPa), 335.2 K1 (for unknown pressure) and 336.22 K3 (at 0.68 MPa). The data1-3 are in reasonable agreement and thus their average value: UCST = 335.7 ± 0.5 K is recommended. The corresponding critical solution composition has been reported in as xcl = 0.47532 (at 5 MPa), xcl = 0.4781 (for unknown pressure) and xcl = 0.5713 (at 0.68 MPa).
        All experimental values reported1,3 have been approximated by an equation based on the scaling law (described in the introduction to this volume) for which the following parameters have been derived:

a1 = 0.7339, a2= 0.1976, b1 = -0.1453, b2 = 0.0325

(mean standard error of estimate was 0.0262).
        For approximation xcl and UCST determined by Pavlov et al.1 have been used. In the opinion of the evaluator, the mutual solubilities calculated by this equation may be treated as tentative. The results of calculations for the selected temperatures are presented in the following table. This relationship, together with experimental points reported by Pavlov et al.1 and Warowny,3 are also presented in Fig. 4.
        Solubilities in the system comprising acetonitrile and butane have been reported in three publications.

        Pavlov et al.1 determined the mutual solubilities of acetonitrile and butane between 276 K and 335 K for unknown pressure by the synthetic method and these data were presented in graphical form only. Gruszkiewicz et al.2 measured the mutual solubilities of (1) and (2) between 298 K and 334 K and pressure 5 to 10 MPa using the synthetic method and reported their results only in the form of an equation. Warowny3 studied the phase equilibrium of the liquid-liquid-gas system and the mutual solubility of (1) and (2) between 319 K and 336 K and over the pressure range 0.45 MPa to 0.68 MPa by the synthetic method.

        The upper critical solution temperature has been reported as 333.59 K2 (at 5 MPa), 335.2 K1 (for unknown pressure) and 336.22 K3 (at 0.68 MPa). The data1-3 are in reasonable agreement and thus their average value: UCST = 335.7 ± 0.5 K is recommended. The corresponding critical solution composition has been reported in as xcl = 0.47532 (at 5 MPa), xcl = 0.4781 (for unknown pressure) and xcl = 0.5713 (at 0.68 MPa).
        All experimental values reported1,3 have been approximated by an equation based on the scaling law (described in the introduction to this volume) for which the following parameters have been derived:

a1 = 0.7339, a2= 0.1976, b1 = -0.1453, b2 = 0.0325

(mean standard error of estimate was 0.0262).
        For approximation xcl and UCST determined by Pavlov et al.1 have been used. In the opinion of the evaluator, the mutual solubilities calculated by this equation may be treated as tentative. The results of calculations for the selected temperatures are presented in the following table. This relationship, together with experimental points reported by Pavlov et al.1 and Warowny,3 are also presented in Fig. 4.

Experimental Data:   (Notes on the Nomenclature)

Calculated mutual solubility of acetonitrile and butane
T/K102 * Mass Fraction w1Mole Fraction x1Comment(s)
298.2  5.70.079Hydrocarbon-rich phase
303.2  7.40.101Hydrocarbon-rich phase
308.2  9.20.125Hydrocarbon-rich phase
313.211.20.151Hydrocarbon-rich phase
318.213.50.181Hydrocarbon-rich phase
323.216.40.217Hydrocarbon-rich phase
328.220.00.262Hydrocarbon-rich phase
329.221.00.274Hydrocarbon-rich phase
330.222.10.287Hydrocarbon-rich phase
331.223.30.301Hydrocarbon-rich phase
332.224.80.318Hydrocarbon-rich phase
333.226.60.339Hydrocarbon-rich phase
334.229.10.368Hydrocarbon-rich phase
334.731.20.391Hydrocarbon-rich phase
298.280.50.854Acetonitrile-rich phase
303.278.10.835Acetonitrile-rich phase
308.275.70.815Acetonitrile-rich phase
313.272.90.792Acetonitrile-rich phase
318.269.70.765Acetonitrile-rich phase
323.265.90.732Acetonitrile-rich phase
328.261.10.690Acetonitrile-rich phase
329.259.90.679Acetonitrile-rich phase
330.258.60.667Acetonitrile-rich phase
331.257.10.653Acetonitrile-rich phase
332.255.30.637Acetonitrile-rich phase
333.253.10.616Acetonitrile-rich phase
334.250.20.588Acetonitrile-rich phase
334.747.80.565Acetonitrile-rich phase
View Figure 4 for this Evaluation

References: (Click a link to see its experimental data associated with the reference)

   1  Pavlov, S.Yu.; Gorshkov, V.A.; Zaikina, T.G.; Bushin, A.N.; Skorikova, V.V., Khim. Prom.-st (Moscow) 11, 810 (1970).
   2  Gruszkiewicz, M.S.; Ott, J.B.; Sipowska, J.T., Thermochim. Acta 245, 155 (1994).
   3  Warowny, W., J. Chem. Eng. Data 41, 689 (1996).