CAS 58656-99-8
:tert-butyl 3-nitrobenzoate
Description:
Tert-butyl 3-nitrobenzoate, with the CAS number 58656-99-8, is an organic compound characterized by its ester functional group. It is derived from benzoic acid, where the hydrogen of the carboxylic acid is replaced by a tert-butyl group, and a nitro group is positioned at the meta position relative to the ester group on the aromatic ring. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is known for its moderate solubility in organic solvents such as ethanol and dichloromethane, while being less soluble in water. Tert-butyl 3-nitrobenzoate is often utilized in organic synthesis and can serve as an intermediate in the production of various pharmaceuticals and agrochemicals. Its reactivity is influenced by the electron-withdrawing nitro group, which can affect the compound's electrophilic and nucleophilic properties. As with many nitro compounds, it should be handled with care due to potential toxicity and environmental concerns.
Formula:C11H13NO4
InChI:InChI=1/C11H13NO4/c1-11(2,3)16-10(13)8-5-4-6-9(7-8)12(14)15/h4-7H,1-3H3
SMILES:CC(C)(C)OC(=O)c1cccc(c1)N(=O)=O
Synonyms:- Benzoic Acid, 3-Nitro-, 1,1-Dimethylethyl Ester
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Found 3 products.
tert-Butyl 3-nitrobenzoate
CAS:Formula:C11H13NO4Purity:98%Color and Shape:SolidMolecular weight:223.2252
