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Download QR code; Print/export Download as PDF; Printable version; ... This is a list of inorganic and organic reagents commonly used in chemistry. Synopsis
Computer-assisted organic synthesis software is a type of application software used in organic chemistry in tandem with computational chemistry to help facilitate the tasks of designing, predicting, and producing chemical reactions. CAOS aims to identify a series of chemical reactions which, from a starting compound, can produce a desired molecule.
This category was created to provide a "home" for inorganic compounds (such as NaBH 4) that are widely used in stoichiometric quantities in organic chemistry, but widely used organic reagents (such as oxalyl chloride) may belong here also. This category is not for catalysts such as Pd.
Download QR code; Print/export ... Well-known reactions and reagents in organic chemistry include ... List of organic compounds;
A chemical graph generator is a software package to generate computer representations of chemical structures adhering to certain boundary conditions. The development of such software packages is a research topic of cheminformatics .
Orac download page: NAMD + VMD: Yes Yes Yes Yes No Yes I Yes Yes Fast, parallel MD, CUDA Proprietary, free academic use, source code Beckman Institute: NWChem: No No Yes Yes No No Yes No No High-performance computational chemistry software, includes quantum mechanics, molecular dynamics and combined QM-MM methods
Organic reactions machine-readable reaction schemes "ORD" [8] 2,000,000 OrgSyn Organic Syntheses: Organic Syntheses, Inc. Reliable chemical reactions Searchable experimental procedures Peer reviewed "OrgSyn search". PDB PDBe Protein Data Bank in Europe EMBL-EBI: has some chemicals as well as proteins "PDBe". PATENTSCOPE: WIPO "PATENTSCOPE ...
The reaction can also be carried out under mildly acidic conditions by way of the same intermediate using a hypervalent iodine compound in aqueous solution. [1] An example published in Organic Syntheses is the conversion of cyclobutanecarboxamide , easily synthesized from cyclobutylcarboxylic acid , to cyclobutylamine . [ 2 ]