CAS 890097-80-0

Phenol, 3-(3-chloro-3-buten-1-yl)-, 1-acetate

Description:

Phenol, 3-(3-chloro-3-buten-1-yl)-, 1-acetate, also known by its CAS number 890097-80-0, is an organic compound characterized by the presence of a phenolic structure with an acetate group and a chloroalkene substituent. This compound typically exhibits a colorless to pale yellow appearance and is soluble in organic solvents. Its molecular structure includes a phenolic hydroxyl group, which imparts certain reactivity, particularly in electrophilic substitution reactions. The chloroalkene moiety can participate in various chemical reactions, including nucleophilic substitutions and polymerization processes. Due to the presence of both the chloro and acetate functional groups, this compound may exhibit biological activity, making it of interest in fields such as medicinal chemistry and agrochemicals. Safety considerations are important, as compounds containing chlorine can pose environmental and health risks. Overall, the unique combination of functional groups in this compound contributes to its potential applications and reactivity in organic synthesis.

Formula: C₁₂H₁₃ClO₂

InChI: InChI=1S/C12H13ClO2/c1-9(13)6-7-11-4-3-5-12(8-11)15-10(2)14/h3-5,8H,1,6-7H2,2H3

InChI key: InChIKey=OTVLKPREPCFLQL-UHFFFAOYSA-N

SMILES: O(C(C)=O)C1=CC(CCC(=C)Cl)=CC=C1

Synonyms:

• Phenol, 3-(3-chloro-3-buten-1-yl)-, 1-acetate