Description

3-(4-Oxobutyl)-1H-Indole-5-Carbonitrile is a versatile indole-based chemical intermediate featuring both a nitrile and a ketone functional group. This molecular structure makes it a valuable building block for the synthesis of more complex heterocyclic compounds and active pharmaceutical ingredients (APIs). It is primarily sought after by research and development teams in the pharmaceutical, agrochemical, and advanced materials sectors for creating novel molecules with targeted biological or physical properties.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of potential drug candidates, particularly those targeting neurological or oncological pathways.
• Agrochemical Research: Used in the development of new herbicides, fungicides, or plant growth regulators due to its bioactive indole scaffold.
• Organic Synthesis Building Block: Serves as a versatile starting material for constructing complex heterocycles, such as fused indole systems, through reactions at its ketone and nitrile groups.
• Material Science Research: Investigated for the preparation of specialty polymers or organic electronic materials where the indole unit can contribute to charge transport properties.
• Biochemical Probe Development: Utilized in medicinal chemistry to create molecular probes for studying enzyme function or receptor binding.

Basic Information

Product Name	3-(4-Oxobutyl)-1H-Indole-5-Carbonitrile
CAS No.	913730-89-9
Molecular Formula	C₁₃H₁₂N₂O
Molecular Weight	212.25 g/mol
Synonyms	1H-Indole-5-carbonitrile, 3-(4-oxobutyl)-; 3-(4-Oxobutyl)indole-5-carbonitrile; 4-(5-Cyano-1H-indol-3-yl)butan-1-one; Butan-1-one, 4-(5-cyano-1H-indol-3-yl)-; 913730-89-9
EINECS	Contact for details

Quality Control

Our 3-(4-Oxobutyl)-1H-Indole-5-Carbonitrile is produced under a strict quality management system. Each batch undergoes comprehensive analytical testing, including HPLC for purity and identity confirmation via spectroscopic methods (NMR, IR), to ensure it meets the high standards required for research and development applications. A Certificate of Analysis (COA) detailing all test results is provided with every shipment.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at controlled room temperature (15-25°C). Keep away from strong oxidizing agents and bases. For long-term storage, consider storing under an inert atmosphere to preserve stability.

Specification

Item	Specification
Appearance	Off-white to light yellow crystalline powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Conforms to reference
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.