
CAS 87894-21-1
:tert-butyl 3-oxohept-6-enoate
Description:
Tert-butyl 3-oxohept-6-enoate is an organic compound characterized by its ester functional group, which is derived from the reaction of tert-butyl alcohol and a carboxylic acid. This compound features a heptenoate structure, indicating the presence of a seven-carbon chain with a double bond and a ketone functional group at the third carbon. The tert-butyl group contributes to its steric bulk, influencing its reactivity and solubility. Typically, compounds like tert-butyl 3-oxohept-6-enoate are colorless to pale yellow liquids with a pleasant odor. They are generally soluble in organic solvents but may have limited solubility in water due to their hydrophobic alkyl chains. This compound can participate in various chemical reactions, including nucleophilic additions and polymerizations, making it valuable in organic synthesis and industrial applications. Safety data sheets should be consulted for handling and storage guidelines, as with many organic compounds, it may pose health hazards if not managed properly.
Formula:C11H18O3
InChI:InChI=1S/C11H18O3/c1-5-6-7-9(12)8-10(13)14-11(2,3)4/h5H,1,6-8H2,2-4H3
InChI key:VLGMZQAIQUOQSH-UHFFFAOYSA-N
SMILES:CC(C)(C)OC(=O)CC(=O)CCC=C
Synonyms:- 6-Heptenoic acid, 3-oxo-, 1,1-dimethylethyl ester
- tert-butyl 3-oxohept-6-enoate
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