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These generators are the core of CASE systems. In a generator, the molecular formula is the basic input. If fragments are obtained from the experimental data, they can also be used as inputs to accelerate structure generation. The first structure generators were versions of graph generators modified for chemical purposes.
Much of chemistry research is focused on the synthesis and characterization of beneficial products, as well as the detection and removal of undesirable products. Synthetic chemists can be subdivided into research chemists who design new chemicals and pioneer new methods for synthesizing chemicals, as well as process chemists who scale up chemical production and make it safer, more ...
2,2,2-Trifluoroethanol is the organic compound with the formula CF 3 CH 2 OH. Also known as TFE or trifluoroethyl alcohol, this colourless, water-miscible liquid has a smell reminiscent of ethanol. Due to the electronegativity of the trifluoromethyl group, this alcohol exhibits a stronger acidic character compared to ethanol.
An example of the difference is the empirical formula for glucose, which is CH 2 O (ratio 1:2:1), while its molecular formula is C 6 H 12 O 6 (number of atoms 6:12:6). For water, both formulae are H 2 O. A molecular formula provides more information about a molecule than its empirical formula, but is more difficult to establish.
Similarly, H 2 O is most often simply called water in English, though other chemical names do exist. Single atom anions are named with an -ide suffix: for example, H − is hydride . Compounds with a positive ion ( cation ): The name of the compound is simply the cation's name (usually the same as the element's), followed by the anion.
Monobromotoluene isomers [1] [2] [3] Common name Structure Systematic name: 1-bromo-2-methylbenzene 1-bromo-3-methylbenzene 1-bromo-4-methylbenzene Molecular formula: C 7 H 7 Br (C 6 H 4 BrCH 3) Molar mass: 171.03 g/mol Appearance colorless liquid colorless liquid white crystalline solid CAS number [95-46-5] [591-17-3]
2,3,3,3-Tetrafluoropropene, HFO-1234yf, is a hydrofluoroolefin (HFO) with molecular formula CH 2 =CFCF 3. Its primary application is as a refrigerant with low global warming potential (GWP). [1] [2] As a refrigerant, it is designated R-1234yf [1] and marketed under the names Opteon YF by Chemours and as Solstice YF by Honeywell. [3]
Propiolaldehyde is an organic compound with molecular formula HC 2 CHO. It is the simplest chemical compound containing both alkyne and aldehyde functional groups. It is a colorless liquid with explosive properties. [1]