CAS 56029-47-1
:Ethyl 6-(1,1-dimethylethyl)-3-pyridinecarboxylate
Description:
Ethyl 6-(1,1-dimethylethyl)-3-pyridinecarboxylate, identified by its CAS number 56029-47-1, is an organic compound characterized by its pyridine ring structure, which is a six-membered aromatic ring containing one nitrogen atom. This compound features an ethyl ester functional group, contributing to its reactivity and solubility properties. The presence of the bulky 1,1-dimethylethyl group (also known as tert-butyl) at the 6-position of the pyridine ring significantly influences its steric and electronic properties, potentially enhancing its stability and affecting its interactions in chemical reactions. Ethyl 6-(1,1-dimethylethyl)-3-pyridinecarboxylate is typically a colorless to pale yellow liquid with a characteristic odor, and it is soluble in organic solvents. Its applications may include use in organic synthesis, as a building block in pharmaceuticals, or as an intermediate in the production of agrochemicals. As with many organic compounds, safety precautions should be observed when handling this substance due to potential toxicity and reactivity.
Formula:C12H17NO2
InChI:InChI=1S/C12H17NO2/c1-5-15-11(14)9-6-7-10(13-8-9)12(2,3)4/h6-8H,5H2,1-4H3
InChI key:InChIKey=KCHGPVFBVQUNQB-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C=CC(C(C)(C)C)=NC1
Synonyms:- 3-Pyridinecarboxylic acid, 6-(1,1-dimethylethyl)-, ethyl ester
- Ethyl 6-(1,1-dimethylethyl)-3-pyridinecarboxylate
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