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3,3,3-Trifluoro-2-(5-methyl-1H-indol-3-yl)propanoic acid

CAS 252729-38-7Formula C12H10F3NO2MW 257.21PubChem 91658669

This compound is a trifluorinated propanoic acid derivative featuring a 5-methyl-1H-indole moiety. Classified as a research-oriented/research-oriented molecule, it is of interest in medicinal chemistry and drug discovery research.

Loading RDKit molecule structure...
InChIKey: LKHIMJBMQONIHF-UHFFFAOYSA-NC12H10F3NO2 | MW 257.21

Chemical Identity

Molecular Formula

C12H10F3NO2

Molecular Weight

257.21 g/mol

Exact Mass

257.066363

PubChem CID

91658669

SMILES String

Cc1ccc2[nH]cc(C(C(=O)O)C(F)(F)F)c2c1

Names & Synonyms

F4038383,3,3-Trifluoro-2-(5-methyl-1H-indol-3-yl)propionic acid
External Identifiers
MFCD28134364CHEMBL4861560AKOS037654332KS-9421

Catalog Overview

3,3,3-Trifluoro-2-(5-methyl-1H-indol-3-yl)propanoic acid is an organic compound with the molecular formula C12H10F3NO2 and a molecular weight of 257. 21 g/mol. It features a trifluoromethyl group and a carboxylic acid functionality attached to a chiral carbon, which is also substituted with a 5-methyl-1H-indole ring system. This structure places it within the category of research-oriented and research-oriented molecules, suggesting potential for diverse applications in pharmaceutical and biochemical research.

Use Context

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  • COA, SDS, pricing, and fulfillment workflow
Read more catalog context

3,3,3-Trifluoro-2-(5-methyl-1H-indol-3-yl)propanoic acid is an organic compound with the molecular formula C12H10F3NO2 and a molecular weight of 257.21 g/mol. It features a trifluoromethyl group and a carboxylic acid functionality attached to a chiral carbon, which is also substituted with a 5-methyl-1H-indole ring system. This structure places it within the category of research-oriented and research-oriented molecules, suggesting potential for diverse applications in pharmaceutical and biochemical research. Its indole core and trifluoromethyl group are common features in biologically active compounds, often influencing metabolic stability, lipophilicity, and binding affinity.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White solid

Physical State

Solid

Melting Point

180.0 °C

Density

1.4 g/cm³

Water Solubility

Slightly soluble

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • Handle with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed hazard information and handling precautions.

Related Products / Graph Discovery

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