CAS 42122-44-1

2-Propynoic acid, 3-(4-fluorophenyl)-, methyl ester

Description:

2-Propynoic acid, 3-(4-fluorophenyl)-, methyl ester, also known by its CAS number 42122-44-1, is an organic compound characterized by its ester functional group and a propynoic acid backbone. This compound features a methyl ester group, which enhances its solubility in organic solvents and may influence its reactivity. The presence of the 4-fluorophenyl substituent introduces unique electronic properties, potentially affecting the compound's acidity and reactivity due to the electron-withdrawing nature of the fluorine atom. Typically, compounds of this type exhibit moderate to high stability under standard conditions but may undergo hydrolysis in the presence of water or under acidic or basic conditions. The compound's structure suggests potential applications in organic synthesis, pharmaceuticals, or as an intermediate in chemical reactions. Its specific physical properties, such as boiling point, melting point, and solubility, would depend on the molecular interactions and the presence of functional groups. As with all chemical substances, safety data should be consulted to understand handling and toxicity considerations.

Formula: C₁₀H₇FO₂

InChI: InChI=1S/C10H7FO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-3,5-6H,1H3

InChI key: InChIKey=RXGVUTFSIPIPDU-UHFFFAOYSA-N

SMILES: C(#CC(OC)=O)C1=CC=C(F)C=C1

Synonyms:

• Methyl 1-(4-fluorophenyl)propynoate
• Methyl 4-fluorophenylpropiolate
• 2-Propynoic acid, 3-(4-fluorophenyl)-, methyl ester
• Methyl 3-(4-fluorophenyl)propiolate
• (4-Fluorophenyl)propynoic acid methyl ester

methyl 3-(4-fluorophenyl)prop-2-ynoate

CAS: 42122-44-1

Formula: C₁₀H₇FO₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 178.1598

Ref: IN-DA00CLQN

Methyl 3-(4-fluorophenyl)propiolate

CAS: 42122-44-1

Methyl 3-(4-fluorophenyl)propiolate

Purity: 98%

Molecular weight: 178.16g/mol

Ref: 54-PC99974

METHYL 3-(4-FLUOROPHENYL)PROP-2-YNOATE

CAS: 42122-44-1

Formula: C₁₀H₇FO₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 178.162

Ref: 10-F514029

Methyl 3-(4-fluorophenyl)prop-2-ynoate

CAS: 42122-44-1

Methyl 3-(4-fluorophenyl)prop-2-ynoate is an organic compound with the formula CHFO. It is a colorless liquid that is soluble in most organic solvents. Methyl 3-(4-fluorophenyl)prop-2-ynoate has been synthesized and characterized by x-ray crystallography. The compound belongs to the class of esters, which are typically derived from carboxylic acids and alcohols. This ester has a β-unsaturated carbonyl group, which allows for its reactivity with other organic compounds. Methyl 3-(4-fluorophenyl)prop-2-ynoate has been shown to react with primary amides to form isoquinoline amides in nature. The anion of methyl 3-(4-fluorophenyl)prop -2-ynoate is nitrile, which can be detected by XRD.

Formula: C₁₀H₇FO₂

Purity: Min. 95%

Molecular weight: 178.16 g/mol

Ref: 3D-SBA12244