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3-Cyano-5-(Trifluoromethyl)Phenol, 3-Cyano-5-Hydroxybenzotrifluoride CAS NO 1243459-56-4
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CAS No.:1243459-56-4
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
3-Cyano-5-(Trifluoromethyl)Phenol, also known as 3-Cyano-5-Hydroxybenzotrifluoride, is a high-value, multi-functional aromatic intermediate featuring both a cyano and a trifluoromethyl group on the phenol ring. This unique molecular structure makes it a critical building block for synthesizing advanced materials and active pharmaceutical ingredients (APIs) where electronic properties and metabolic stability are paramount. It is essential for R&D and production in the pharmaceutical, agrochemical, and specialty chemical industries seeking to incorporate fluorine and nitrile functionalities into target molecules.
Application
- Pharmaceutical Intermediate: A key synthon for the development of novel drug candidates, particularly in kinase inhibitors, anti-inflammatory agents, and CNS-active compounds where the trifluoromethyl group enhances lipophilicity and metabolic stability.
- Agrochemical Synthesis: Used in the production of advanced herbicides, fungicides, and insecticides, where the cyano and trifluoromethyl groups contribute to biological activity and environmental persistence.
- Liquid Crystal & OLED Materials: Serves as a precursor for constructing polar aromatic cores in electronic display materials, leveraging its electron-withdrawing groups to fine-tune molecular polarity and photophysical properties.
- Polymer & Resin Modifier: Incorporated into high-performance polymers to impart specific characteristics such as increased chemical resistance, thermal stability, or altered solubility.
- Organic Synthesis Building Block: Utilized in cross-coupling reactions, nucleophilic aromatic substitutions, and as a precursor for further functionalization to carboxylic acids, amides, or heterocycles.
Basic Information
| Item | Details |
|---|---|
| Product Name | 3-Cyano-5-(Trifluoromethyl)Phenol |
| CAS No. | 1243459-56-4 |
| Molecular Formula | C8H4F3NO |
| Molecular Weight | 187.12 g/mol |
| Synonyms | 3-Cyano-5-Hydroxybenzotrifluoride; 5-Hydroxy-3-(trifluoromethyl)benzonitrile; 3-Hydroxy-5-(trifluoromethyl)benzonitrile; 3-(Trifluoromethyl)-5-hydroxybenzonitrile; Phenol, 3-cyano-5-(trifluoromethyl)-; Benzotrifluoride, 3-cyano-5-hydroxy- |
| EINECS | Contact for details |
Quality Control
Every batch of 3-Cyano-5-(Trifluoromethyl)Phenol is manufactured and tested under a strict quality management system. We ensure compliance with relevant industry standards through rigorous analytical protocols including HPLC, GC, NMR, and mass spectrometry. A comprehensive Certificate of Analysis (COA) detailing purity, identity, and impurity profiles is provided with each shipment to guarantee traceability and batch-to-batch consistency for your critical applications.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at room temperature (15-25°C). This compound is moisture-sensitive (hygroscopic); keep the container tightly sealed under an inert atmosphere if possible to prevent degradation.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white crystalline powder |
| Identification (IR) | Conforms to structure |
| Assay (HPLC) | ≥ 98.0% |
| Melting Point | Contact for details |
| Loss on Drying | ≤ 0.5% |
| Related Substances (HPLC) | Individual impurity ≤ 0.5%; Total impurities ≤ 1.5% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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