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Topological Index and Thermodynamic Properties. I. Empirical Rules on the Boiling Point of Saturated Hydrocarbons
Abstract Empirical relations are proposed for the boiling point (bp) and the topological index (ZG) of a saturated hydrocarbon as bp=alogZG+b or bp=(alogZG+c)⁄\sqrtN+b, where N is the number of the carbon atoms. A number of compounds with or without ring(s) are plotted for these relations. Correlation is generally better for …