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2-(3-Cyano-5-fluorophenyl)propanoic acid

CAS 1536139-32-8Formula C10H8FNO2MW 193.17PubChem 66425093

2-(3-Cyano-5-fluorophenyl)propanoic acid is a fluorinated and cyanated aromatic propanoic acid derivative, characterized by its C10H8FNO2 formula and molecular weight of 193.17. This compound serves as a versatile functionalized intermediate for research and development purposes.

Loading RDKit molecule structure...
InChIKey: JXSBULJYMBFTDK-UHFFFAOYSA-NC10H8FNO2 | MW 193.17

Chemical Identity

Molecular Formula

C10H8FNO2

Molecular Weight

193.17 g/mol

Exact Mass

193.053907

PubChem CID

66425093

SMILES String

CC(C(=O)O)c1cc(F)cc(C#N)c1

Names & Synonyms

2-(3-cyano-5-fluorophenyl)propanoicacid
External Identifiers
AKOS015770213CS-0274842EN300-1137963

Catalog Overview

2-(3-Cyano-5-fluorophenyl)propanoic acid, identified by CAS 1536139-32-8, is an organic compound featuring a propanoic acid moiety attached to a phenyl ring, which is further substituted with a cyano group and a fluorine atom at positions 3 and 5 respectively. With a molecular formula of C10H8FNO2 and a molecular weight of 193.17, this chemical is primarily utilized as a functionalized intermediate in various research and development applications. Its distinct structural features make it a valuable building block for synthesizing more complex molecules, particularly in medicinal chemistry and materials science where fluorinated...

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Read more catalog context

2-(3-Cyano-5-fluorophenyl)propanoic acid, identified by CAS 1536139-32-8, is an organic compound featuring a propanoic acid moiety attached to a phenyl ring, which is further substituted with a cyano group and a fluorine atom at positions 3 and 5 respectively. With a molecular formula of C10H8FNO2 and a molecular weight of 193.17, this chemical is primarily utilized as a functionalized intermediate in various research and development applications. Its distinct structural features make it a valuable building block for synthesizing more complex molecules, particularly in medicinal chemistry and materials science where fluorinated and cyanated aromatic systems are desired.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline powder

Physical State

Solid

Melting Point

145.0 °C

Boiling Point

300.0 °C

Density

1.35 g/cm³

Water Solubility

Slightly soluble

Flash Point

165.0 °C

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 2-(3-Cyano-5-fluorophenyl)propanoic acid in a well-ventilated area or fume hood. Wear appropriate Personal Protective Equipment (PPE), including safety goggles, gloves, and a lab coat, to prevent skin and eye contact. Avoid inhalation of dust or vapors. In case of contact, wash thoroughly with soap and water. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for comprehensive safety information before handling.

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