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2-Hydroxy-2-Trifluoromethyl-Pent-4-Enoic Acid Methyl Ester CAS NO 114645-32-8
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CAS No.:114645-32-8
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
2-Hydroxy-2-Trifluoromethyl-Pent-4-Enoic Acid Methyl Ester is a high-value fluorinated building block essential for advanced organic synthesis. Its unique structure, featuring both a reactive hydroxyl group and a trifluoromethyl moiety, makes it a critical intermediate for introducing fluorine into target molecules, thereby enhancing their metabolic stability and lipophilicity. This compound is primarily sought after by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for the creation of novel active ingredients.
Application
- Pharmaceutical Intermediate: A key synthon for the development of fluorinated active pharmaceutical ingredients (APIs), particularly in protease inhibitor and CNS drug research.
- Agrochemical Synthesis: Used in the production of advanced herbicides and fungicides where the trifluoromethyl group improves biological activity and environmental persistence.
- Material Science Precursor: Serves as a monomer or cross-linking agent in the synthesis of specialty fluorinated polymers with unique surface properties and chemical resistance.
- Liquid Crystal & OLED Materials: Employed in the synthesis of fluorinated components for electronic displays and organic light-emitting diodes to optimize performance.
- Asymmetric Synthesis: Utilized as a chiral building block or auxiliary in stereoselective reactions to construct complex molecular architectures.
- Fluorine-19 NMR Spectroscopy: Can be used as a reference standard or probe in analytical chemistry due to its distinct fluorine signature.
Basic Information
| Product Name | 2-Hydroxy-2-Trifluoromethyl-Pent-4-Enoic Acid Methyl Ester |
| CAS No. | 114645-32-8 |
| Molecular Formula | C8H9F3O3 |
| Molecular Weight | 210.15 g/mol |
| Synonyms | Methyl 2-hydroxy-2-(trifluoromethyl)pent-4-enoate; 2-(Trifluoromethyl)-2-hydroxy-4-pentenoic acid methyl ester; 4-Pentenoic acid, 2-hydroxy-2-(trifluoromethyl)-, methyl ester; Methyl 2-hydroxy-2-trifluoromethyl-4-pentenoate; 2-Hydroxy-2-trifluoromethyl-4-pentenoic acid methyl ester; 2-Trifluoromethyl-2-hydroxy-4-pentenoic acid methyl ester |
| EINECS | Contact for details |
Quality Control
Every batch of 2-Hydroxy-2-Trifluoromethyl-Pent-4-Enoic Acid Methyl Ester is manufactured and tested under a strict quality management system. We provide comprehensive analytical data to ensure the compound meets the high-purity standards required for sensitive synthetic applications. A detailed Certificate of Analysis (COA) is supplied with each shipment, confirming identity, purity, and impurity profiles as determined by GC, HPLC, and NMR.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). Due to its properties, keep the container tightly sealed to minimize exposure to moisture and highly volatile loss. Incompatible with strong bases and fluorides.
Specification
| Item | Specification |
|---|---|
| Appearance | Colorless to pale yellow liquid |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Purity (GC/HPLC) | ≥ 97.0% |
| Water Content (KF) | ≤ 0.5% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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