Cas no 1134820-66-8 (3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride)

3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride is a fluorinated aromatic compound featuring both amino and chloro substituents on a benzene ring, with a trifluoromethyl group enhancing its electronic properties. The hydrochloride salt form improves stability and solubility, making it suitable for synthetic applications. This intermediate is particularly valuable in pharmaceutical and agrochemical research, where its trifluoromethyl group contributes to enhanced bioactivity and metabolic stability. The presence of reactive amino and chloro groups allows for further functionalization, enabling diverse derivatization pathways. Its well-defined structure and high purity make it a reliable building block for the development of specialized organic compounds.
3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride structure
1134820-66-8 structure
Product Name:3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride
CAS No:1134820-66-8
MF:C7H6Cl2F3N
MW:232.030450344086
CID:3152775
PubChem ID:24728591
Update Time:2025-11-02

3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride
    • SCHEMBL1971196
    • A836487
    • 3-chloranyl-5-(trifluoromethyl)aniline hydrochloride
    • 3-chloro-5-(trifluoromethyl)aniline hydrochloride
    • AJPYZXXRNGJZGW-UHFFFAOYSA-N
    • 3-chloro-5-(trifluoromethyl)aniline;hydrochloride
    • 1134820-66-8
    • Inchi: 1S/C7H5ClF3N.ClH/c8-5-1-4(7(9,10)11)2-6(12)3-5;/h1-3H,12H2;1H
    • InChI Key: AJPYZXXRNGJZGW-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C=C(C(F)(F)F)C=1)N.Cl

Computed Properties

  • Exact Mass: 230.9829391Da
  • Monoisotopic Mass: 230.9829391Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 0
  • Complexity: 159
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26?2

3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
A633645-1mg
3-Amino-5-trifluoromethyl-1-chlorobenzene Hydrochloride
1134820-66-8
1mg
$ 50.00 2022-06-07
TRC
A633645-2mg
3-Amino-5-trifluoromethyl-1-chlorobenzene Hydrochloride
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$ 65.00 2022-06-07
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Additional information on 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride

3-Amino-5-trifluoromethyl-1-chlorobenzene Hydrochloride (CAS No. 1134820-66-8): A Comprehensive Overview

3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride (CAS No. 1134820-66-8) is a specialized organic compound with significant applications in pharmaceutical and agrochemical research. This compound, featuring both amino and trifluoromethyl functional groups, is widely recognized for its unique chemical properties and versatility in synthetic chemistry. Its molecular formula is C7H6ClF3N·HCl, and it is often utilized as a key intermediate in the development of novel bioactive molecules.

The 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride structure combines a benzene ring substituted with chlorine, an amino group, and a trifluoromethyl group, making it a valuable building block in medicinal chemistry. Researchers frequently explore its potential in designing drug candidates due to the electron-withdrawing effects of the trifluoromethyl group, which can enhance binding affinity and metabolic stability. Additionally, its hydrochloride salt form improves solubility, facilitating its use in various reaction conditions.

In recent years, the demand for fluorinated compounds like 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride has surged, driven by their prominence in pharmaceutical intermediates and agrochemical formulations. The trifluoromethyl group, in particular, is a hotspot in drug discovery, as it often improves the pharmacokinetic properties of molecules. This aligns with current trends in the industry, where researchers seek fluorine-containing building blocks to optimize drug efficacy and reduce side effects.

From a synthetic perspective, 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride serves as a precursor in the preparation of heterocyclic compounds, which are prevalent in many FDA-approved drugs. Its reactivity allows for further functionalization, enabling chemists to create diverse molecular architectures. This adaptability makes it a sought-after reagent in both academic and industrial laboratories.

The compound’s role extends beyond pharmaceuticals. In material science, derivatives of 3-Amino-5-trifluoromethyl-1-chlorobenzene have been investigated for their potential in creating advanced polymers and coatings with enhanced durability and chemical resistance. The incorporation of fluorine atoms often leads to materials with superior thermal and oxidative stability, addressing growing needs in high-performance applications.

Market insights indicate a steady rise in the procurement of 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride, particularly from contract research organizations (CROs) and custom synthesis providers. As the pharmaceutical industry continues to prioritize precision medicine and targeted therapies, the demand for specialized intermediates like this compound is expected to grow further.

For researchers and procurement specialists, understanding the storage and handling of 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride is crucial. While it is not classified as hazardous under standard regulations, proper storage in a cool, dry environment is recommended to maintain its stability. Suppliers typically provide detailed technical data sheets (TDS) and certificates of analysis (CoA) to ensure safe and effective usage.

In summary, 3-Amino-5-trifluoromethyl-1-chlorobenzene hydrochloride (CAS No. 1134820-66-8) is a multifaceted compound with broad applications in drug discovery, agrochemicals, and material science. Its unique structural features and reactivity make it indispensable in modern synthetic chemistry. As innovation in fluorine chemistry advances, this compound is poised to remain a critical tool for researchers worldwide.

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