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3-Buten-2-One, 4-(3-Methyloxiranyl)-, [2S-[2Alpha(E),3Beta]]- (9Ci) CAS NO 201035-61-2


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CAS No.:201035-61-2

Grade:Pharmacy Grade

Content:99.9%

Brand:Customizable

Packaging:Customizable

Description

3-Buten-2-One, 4-(3-Methyloxiranyl)-, [2S-[2Alpha(E),3Beta]]- (9Ci) is a high-purity, stereochemically defined chiral building block featuring both an α,β-unsaturated ketone and an epoxide functional group. This unique bifunctional structure makes it a critical intermediate for the synthesis of complex, biologically active molecules, offering precise control over stereochemistry in downstream reactions. It is primarily utilized by research institutions and pharmaceutical companies engaged in the development of novel active pharmaceutical ingredients (APIs), agrochemicals, and other fine chemicals where specific stereochemistry is paramount for efficacy.

Application

  • Pharmaceutical Intermediate: A key chiral synthon for the asymmetric synthesis of complex drug candidates, particularly in oncology, antiviral, and anti-inflammatory research.
  • Agrochemical Synthesis: Used in the production of advanced, stereospecific pesticides and herbicides where the specific enantiomer is crucial for activity and environmental safety.
  • Fine Chemical Building Block: Serves as a versatile precursor in organic synthesis for creating natural product analogs, flavors, and fragrances with defined stereocenters.
  • Academic & R&D: Employed in methodological chemistry research for developing new catalytic asymmetric reactions and studying epoxide ring-opening kinetics.
  • Material Science Research: Potential monomer or cross-linker for developing novel polymers with specific optical or mechanical properties derived from its rigid, functionalized structure.

Basic Information

Product Name 3-Buten-2-One, 4-(3-Methyloxiranyl)-, [2S-[2Alpha(E),3Beta]]- (9Ci)
CAS No. 201035-61-2
Molecular Formula C7H10O2
Molecular Weight 126.15 g/mol
Synonyms (2S,3S)-4-(Oxiran-2-yl)but-3-en-2-one; (2S,3S)-4-(2-Methyloxiran-2-yl)but-3-en-2-one; (E)-4-[(2S,3S)-3-Methyloxiran-2-yl]but-3-en-2-one; (2S,3S)-4-(3-Methyloxiranyl)-3-buten-2-one; Chiral Epoxy Enone; (2S,3S)-Epoxybutenone; A stereoisomer of 4-(3-Methyloxiranyl)-3-buten-2-one
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Quality Control

Every batch of 3-Buten-2-One, 4-(3-Methyloxiranyl)-, [2S-[2Alpha(E),3Beta]]- (9Ci) is manufactured and analyzed under strict quality management systems. We employ advanced chromatographic and spectroscopic techniques to ensure exceptional chiral purity and chemical identity, meeting the stringent requirements for pharmaceutical R&D. A comprehensive Certificate of Analysis (COA) detailing purity, enantiomeric excess, and impurity profiles is provided with each shipment to guarantee traceability and batch-to-batch consistency.

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). This compound may be sensitive to moisture and prolonged exposure to air; containers should be kept tightly sealed under an inert atmosphere after opening.

Specification

Item Specification
Appearance Colorless to pale yellow liquid
Identification (IR) Conforms to reference spectrum
Identification (NMR) Conforms to structure
Purity (HPLC) ≥ 97.0%
Enantiomeric Excess (Chiral HPLC) ≥ 98.0%
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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