Cas no 1261492-69-6 (5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde)

5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde is a biphenyl-based aromatic aldehyde featuring chloro and trifluoromethyl substituents, which enhance its reactivity and utility in organic synthesis. The presence of the electron-withdrawing trifluoromethyl group and chloro substituent influences its electrophilic properties, making it a valuable intermediate in the preparation of pharmaceuticals, agrochemicals, and advanced materials. Its aldehyde functionality allows for further derivatization through condensation, reduction, or nucleophilic addition reactions. The compound’s structural features contribute to its stability and compatibility with a range of synthetic conditions, facilitating its use in cross-coupling and functional group transformations. It is particularly useful in medicinal chemistry for designing bioactive molecules.
5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde structure
1261492-69-6 structure
Product Name:5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde
CAS No:1261492-69-6
MF:C14H8ClF3O
MW:284.660933494568
CID:4790280
Update Time:2025-11-02

5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde Chemical and Physical Properties

Names and Identifiers

    • 5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde
    • Inchi: 1S/C14H8ClF3O/c15-12-5-4-10(8-19)13(7-12)9-2-1-3-11(6-9)14(16,17)18/h1-8H
    • InChI Key: NEOCVTHEIKTJJA-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(C=O)=C(C=1)C1C=CC=C(C(F)(F)F)C=1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 318
  • XLogP3: 4.5
  • Topological Polar Surface Area: 17.1

5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A011006377-250mg
5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde
1261492-69-6 97%
250mg
$484.80 2023-09-03
Alichem
A011006377-500mg
5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde
1261492-69-6 97%
500mg
$847.60 2023-09-03
Alichem
A011006377-1g
5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde
1261492-69-6 97%
1g
$1445.30 2023-09-03

Additional information on 5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde

Comprehensive Overview of 5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde (CAS No. 1261492-69-6)

5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde (CAS No. 1261492-69-6) is a specialized organic compound widely recognized for its unique structural features and versatile applications in pharmaceutical and agrochemical research. This compound belongs to the biphenyl carbaldehyde family, characterized by a chloro substituent at the 5-position and a trifluoromethyl group at the 3'-position of the biphenyl backbone. Its molecular formula, C14H8ClF3O, highlights its potential as a key intermediate in synthetic chemistry.

The growing interest in trifluoromethylated compounds like 5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde stems from their enhanced metabolic stability and lipophilicity, which are critical in drug design. Researchers frequently search for "trifluoromethyl in drug discovery" or "biphenyl derivatives applications," reflecting the compound's relevance in modern medicinal chemistry. Its aldehyde functional group also makes it a valuable precursor for synthesizing Schiff bases, which are explored for their antimicrobial and anticancer properties.

In agrochemical applications, 5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde is investigated for its role in developing novel pesticides. The trifluoromethyl group is known to improve the bioactivity and environmental persistence of agrochemicals, aligning with trends like "sustainable crop protection" and "green chemistry in agriculture." This compound's structural adaptability allows researchers to fine-tune properties such as solubility and target specificity, addressing challenges in pest resistance management.

From a synthetic perspective, the compound's chloro and trifluoromethyl substituents offer distinct reactivity patterns, enabling diverse transformations. Popular queries such as "cross-coupling reactions with biphenyl aldehydes" or "electrophilic aromatic substitution in trifluoromethylated arenes" underscore its utility in organic synthesis. Advanced techniques like palladium-catalyzed coupling or nucleophilic addition to the aldehyde group further expand its synthetic potential.

Environmental and regulatory considerations are also pivotal when discussing 5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde. While not classified as hazardous, its handling requires standard laboratory precautions. The compound's stability under various conditions makes it a candidate for "high-throughput screening" and "automated synthesis platforms," topics gaining traction in industrial R&D. Analytical methods such as HPLC and NMR are commonly employed to ensure purity, a frequent concern for buyers searching for "CAS 1261492-69-6 purity standards."

In conclusion, 5-Chloro-3'-(trifluoromethyl)biphenyl-2-carbaldehyde (CAS No. 1261492-69-6) exemplifies the intersection of innovation and practicality in chemical research. Its multifaceted applications—from drug discovery to agrochemical development—coupled with its synthetic flexibility, position it as a compound of enduring interest. As the scientific community continues to explore "fluorinated building blocks" and "biphenyl-based scaffolds," this compound will undoubtedly remain a focal point in cutting-edge research.

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