3-Ethynyl-benzoic acid methyl ester, with the CAS number 10602-06-9, is an organic compound characterized by its structure, which includes a benzoic acid moiety substituted with an ethynyl group at the meta position and a methyl ester functional group. This compound typically appears as a colorless to pale yellow liquid or solid, depending on its purity and temperature. It is known for its aromatic properties due to the presence of the benzene ring, which contributes to its stability and reactivity. The ethynyl group introduces a triple bond, making it a useful intermediate in organic synthesis, particularly in the preparation of more complex molecules. The methyl ester functionality enhances its solubility in organic solvents, making it suitable for various applications in chemical research and industry. Additionally, this compound may exhibit specific reactivity patterns typical of both carboxylic acids and alkynes, allowing for diverse chemical transformations. Safety data should be consulted for handling and storage, as with all chemical substances.

3-ETHYNYL-BENZOIC ACID METHYL ESTER

Methyl 3-ethynylbenzoate

3-Ethynylbenzoic acid methyl ester

Methyl 3-ethynylbenzoate is a ligand that binds to the activated site of enzymes. It is an intramolecular hydrogen donor that can be used in strategies for rationalizing cocatalysts and residues. Methyl 3-ethynylbenzoate can be used in microscopy studies to polymerize polyhedra, which are modifications that occur when the ligand is bound to the active site of enzymes. The chemical structure of methyl 3-ethynylbenzoate has been shown to have a helical conformation.

CAS 10602-06-9: 3-ETHYNYL-BENZOIC ACID METHYL ESTER

Methyl 3-ethynylbenzoate

Ref: 54-OR41056

3-Ethynylbenzoic acid methyl ester

Ref: 10-F047873

Methyl 3-ethynylbenzoate

Ref: 3D-FM75224

Methyl 3-ethynylbenzoate

Ref: IN-DA0038ZN