Computational Study of C–H Insertion Reactions with Ethyl Bromodiazoacetate | Zendy

Bonge Hanne Therese | Zendy; Hansen Tore | Zendy

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Computational Study of C–H Insertion Reactions with Ethyl Bromodiazoacetate

Author(s) -

Bonge Hanne Therese,

Hansen Tore

Publication year - 2010

Publication title -

european journal of organic chemistry

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.825

H-Index - 155

eISSN - 1099-0690

pISSN - 1434-193X

DOI - 10.1002/ejoc.201000531

Subject(s) - chemistry , insertion reaction , hydride , migratory insertion , mechanism (biology) , reaction mechanism , stereochemistry , substrate (aquarium) , computational chemistry , organic chemistry , catalysis , hydrogen , philosophy , oceanography , epistemology , geology

A computational study of C–H insertion reactions between ethyl bromodiazoacetate and three different substrates is presented. The mechanism of the C–H insertion is shown to be substrate dependent; the reaction follows either a concerted mechanism or a two‐step mechanism in which complete hydride transfer precedes C–C bond formation.

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