Octane properties

Methanol has good octane properties compared to gasoline. With a research octane value of 108.6 and a modified motor octane value1 of 88.6 ([R+M]/2 of 98.6),... 

M.C. Croudace and P.J. Jessup, Studies of Octane Properties of Mixtures of Isomeric Hexanes, SAE Technical Paper 881604 (1988). 

Solvent X n-Octane Properties of solvent pairs 259 UNI FAC contributions CH3 2 CH2 6 ... 

The analyst now has available the complete details of the chemical composition of a gasoline all components are identified and quantified. From these analyses, the sample s physical properties can be calculated by using linear or non-linear models density, vapor pressure, calorific value, octane numbers, carbon and hydrogen content. 

Because of the existence of numerous isomers, hydrocarbon mixtures having a large number of carbon atoms can not be easily analyzed in detail. It is common practice either to group the constituents around key components that have large concentrations and whose properties are representative, or to use the concept of petroleum fractions. It is obvious that the grouping around a component or in a fraction can only be done if their chemical natures are similar. It should be kept in mind that the accuracy will be diminished when estimating certain properties particularly sensitive to molecular structure such as octane number or crystallization point. 

Table 5.10 gives octane number examples for some conventional refinery stocks. These are given as orders of magnitude because the properties can vary according to process severity and the specified distillation range. 

Calculational methods. Associating the analysis, the knowledge of the property-structure relationships, and the calculation methods has made possible the replacement of costly and arduous test methods by quicker tests whose results are linked by calculations to the characteristic under study. Some examples are the cetane number, in some cases, the octane number, or the characteristics of LPG (refer to Chapter 3). 

Motor fuels are submitted to strict regulations concerning physical properties and properties of combustion, for which the octane number is the most representative characteristic. 

The products could be classified as a function of various criteria physical properties (in particular, volatility), the way they are created (primary distillation or conversion). Nevertheless, the classification most relevant to this discussion is linked to the end product use LPG, premium gasoline, kerosene and diesel oil, medium and heavy fuels, specialty products like solvents, lubricants, and asphalts. Indeed, the product specifications are generally related to the end use. Traditionally, they have to do with specific properties octane number for premium gasoline, cetane number for diesel oil as well as overall physical properties such as density, distillation curves and viscosity. 

Product characterization aims at defining their end-use properties by means of conventional standard measurements related as well as possible — and in any case, being the object of a large consensus— to end-use properties. We cite for example that octane numbers are supposed to represent the resistance of gasoline to knocking in ignition engines. 

Design Institute for Physical Property Data dimethylformamide dimethylsulfoxide I distribution octane number Economic Commission for Europe j European Economic Community i (Communaute Economique Europeenne)... 

As another example, we shall consider the influence of the number of descriptors on the quality of learning. Lucic et. al. [3] performed a study on QSPR models employing connectivity indices as descriptors. The dataset contained 18 isomers of octane. The physical property for modehng was boiling points. The authors were among those who introduced the technique of orthogonahzation of descriptors. 

The physical properties of polyurethane adhesives result from a special form of phase separation which occurs in the cross-linked polyurethane stmcture. The urethane portions of polyurethanes tend to separate from the polyol portion of the resin, providing good shear strength, good low temperature flexibiUty, and high peel strength. Catalysts such as dibutyltin dilaurate [77-58-7], stannous octoate [1912-83-0], l,4-diazabicyclo[2.2.2]octane... 

The principal class of reactions in the FCC process converts high boiling, low octane normal paraffins to lower boiling, higher octane olefins, naphthenes (cycloparaffins), and aromatics. FCC naphtha is almost always fractionated into two or three streams. Typical properties are shown in Table 5. Properties of specific streams depend on the catalyst, design and operating conditions of the unit, and the cmde properties. 

Proper prediction of the octane of refinery blends is important because octane has traditionally been one of the most expensive gasoline properties... 

As can be seen from Figure 4, LBVs for these components are not constant across the ranges of composition. An iateraction model has been proposed (60) which assumes that the lack of linearity results from the iateraction of pairs of components. An approach which focuses on the difference between the weighted linear average of the components and the actual octane number of the blend (bonus or debit) has also been developed (61). The iadependent variables ia this type of model are statistical functions (averages, variances, etc) of blend properties such as octane, olefins, aromatics, and sulfur. The general statistical problem has been analyzed (62) and the two approaches have been shown to be theoretically similar though computationally different. 

Methane is the main constituent, with a boiling point of 119 K (—245°F). Ethane, with a boiling point of 184 K (—128°F) may be present in amounts up to 10 percent propane, with a boiling point of 231 K (—44°F), up to 3 percent. Butane, pentane, hexane, heptane, and octane may also be present. Physical properties of these hydrocarbons are given in Sec. 2. 

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