CAS 1227594-38-8

5-Fluoro-4-methoxy-1H-indole-3-carboxaldehyde

Description:

5-Fluoro-4-methoxy-1H-indole-3-carboxaldehyde is a chemical compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. The presence of a fluoro group at the 5-position and a methoxy group at the 4-position contributes to its unique reactivity and properties. The aldehyde functional group at the 3-position makes it a versatile intermediate in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its molecular structure allows for potential interactions with biological targets, making it of interest in medicinal chemistry. Additionally, the presence of the fluorine atom can enhance metabolic stability and lipophilicity, which are important factors in drug design. Safety data and handling precautions should be observed, as with any chemical substance, to mitigate risks associated with its use.

Formula: C₁₀H₈FNO₂

InChI: InChI=1S/C10H8FNO2/c1-14-10-7(11)2-3-8-9(10)6(5-13)4-12-8/h2-5,12H,1H3

InChI key: InChIKey=JYCQTVJGOJSZLW-UHFFFAOYSA-N

SMILES: O(C)C1=C2C(NC=C2C=O)=CC=C1F

Synonyms:

• 5-Fluoro-4-methoxy-1H-indole-3-carboxaldehyde
• 1H-Indole-3-carboxaldehyde, 5-fluoro-4-methoxy-