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. 2019 Nov 21;9(65):38017–38031. doi: 10.1039/c9ra07057e

Percentage average absolute deviations (% AAD) for the vapour pressure Pvap and saturated-liquid density ρsat considered in the estimation procedure for the development of the SAFT-γ Mie model parameters and the assessment of the performance of the model for pure compounds of interest here. NP and Nρ are the number of data points of Pvap and ρsat, respectively. The references to the experimental data are denoted in each case.

Compound T/K N P % AAD Pvap Ref. T/K N ρ % AAD ρsat Ref.
2-Butenoic acid 352–460 23 2.67 33
2-Pentenoic acid 350–450 11 34.5 34
2-Hexenoic acid 352–437 30 11.2 32
3-Methyl-2-butenoic acid 350–530 19 20.7 32 350–530 19 2.18 32
2-Methyl-1-butene 274–413 30 3.63 34 183–408 24 4.37 34
2-Methyl-1,3-butadiene 215–328 58 1.59 34 193–433 14 5.06 34
Average 7.96 3.94