Cas no 893737-78-5 (3'-Acetamidobiphenyl-3-carboxylic acid)

3'-Acetamidobiphenyl-3-carboxylic acid is a biphenyl derivative featuring both acetamido and carboxylic acid functional groups, making it a versatile intermediate in organic synthesis and pharmaceutical research. The compound's structure allows for further functionalization, enabling applications in the development of bioactive molecules and fine chemicals. Its biphenyl core provides rigidity, which can be advantageous in designing compounds with specific steric or electronic properties. The carboxylic acid group facilitates conjugation or salt formation, while the acetamido moiety offers potential for hydrogen bonding or additional derivatization. This compound is particularly useful in medicinal chemistry for constructing targeted molecular frameworks.
3'-Acetamidobiphenyl-3-carboxylic acid structure
893737-78-5 structure
Product Name:3'-Acetamidobiphenyl-3-carboxylic acid
CAS No:893737-78-5
MF:C15H13NO3
MW:255.268624067307
MDL:MFCD06802367
CID:856320
PubChem ID:20099982
Update Time:2025-10-12

3'-Acetamidobiphenyl-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 3'-Acetamidobiphenyl-3-carboxylic acid
    • 3-(3-acetamidophenyl)benzoic acid
    • 3'-(ACETYLAMINO)[1,1'-BIPHENYL]-3-CARBOXYLIC ACID
    • 3-Acetamidobiphenyl-3-carboxylic acid
    • DTXSID90602471
    • MFCD06802367
    • BB 0223447
    • EN300-7383946
    • CHEMBL4170628
    • AKOS004114851
    • AV7
    • BS-23035
    • 3'-Acetamido[1,1'-biphenyl]-3-carboxylic acid
    • 3'-acetamidobiphenyl-3-carboxylicacid
    • 893737-78-5
    • MDL: MFCD06802367
    • Inchi: 1S/C15H13NO3/c1-10(17)16-14-7-3-5-12(9-14)11-4-2-6-13(8-11)15(18)19/h2-9H,1H3,(H,16,17)(H,18,19)
    • InChI Key: PKQLIAIJVCDASV-UHFFFAOYSA-N
    • SMILES: OC(C1=CC=CC(=C1)C1C=CC=C(C=1)NC(C)=O)=O

Computed Properties

  • Exact Mass: 255.08954328g/mol
  • Monoisotopic Mass: 255.08954328g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 342
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 66.4?2

3'-Acetamidobiphenyl-3-carboxylic acid Pricemore >>

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Additional information on 3'-Acetamidobiphenyl-3-carboxylic acid

Comprehensive Overview of 3'-Acetamidobiphenyl-3-carboxylic acid (CAS No. 893737-78-5): Properties, Applications, and Research Insights

3'-Acetamidobiphenyl-3-carboxylic acid (CAS No. 893737-78-5) is a specialized organic compound with a biphenyl backbone, featuring an acetamido group at the 3' position and a carboxylic acid moiety at the 3 position. This unique structure makes it a valuable intermediate in pharmaceutical and material science research. The compound's molecular formula is C15H13NO3, and its systematic name reflects its functional groups, which are critical for its reactivity and applications.

In recent years, the demand for biphenyl derivatives like 3'-Acetamidobiphenyl-3-carboxylic acid has surged due to their role in drug discovery and development. Researchers are particularly interested in its potential as a building block for small-molecule inhibitors and bioconjugates, aligning with trends in personalized medicine and targeted therapies. The compound's carboxylic acid group allows for easy derivatization, enabling the creation of esters, amides, and other derivatives for diverse applications.

The synthesis of 3'-Acetamidobiphenyl-3-carboxylic acid typically involves multi-step organic reactions, including Suzuki-Miyaura cross-coupling to form the biphenyl core, followed by selective functionalization. Its purity and stability are crucial for reproducibility in research, making analytical techniques like HPLC and NMR spectroscopy essential for quality control. These methods ensure compliance with stringent standards required in pharmaceutical intermediates and high-value chemicals.

From an industrial perspective, 3'-Acetamidobiphenyl-3-carboxylic acid is often discussed in the context of green chemistry and sustainable synthesis. Innovations in catalytic processes and solvent-free reactions have been explored to minimize environmental impact while maintaining high yields. This aligns with the growing emphasis on ESG (Environmental, Social, and Governance) principles in chemical manufacturing, a topic frequently searched by professionals in the field.

In material science, the compound's aromatic structure contributes to its utility in designing organic semiconductors and liquid crystals. Its ability to form hydrogen bonds via the acetamido and carboxylic acid groups enhances molecular self-assembly, a property leveraged in advanced materials for electronics and photonics. Such applications are increasingly relevant amid the rise of flexible electronics and IoT devices.

Safety and handling of 3'-Acetamidobiphenyl-3-carboxylic acid follow standard laboratory protocols for organic compounds. While not classified as hazardous, proper storage under inert conditions is recommended to preserve its integrity. Researchers often inquire about its solubility (e.g., in DMSO or methanol) and thermal stability, which are key parameters for experimental design.

The compound's relevance extends to academic circles, where it serves as a case study in retrosynthetic analysis and structure-activity relationships (SAR). Its modular design exemplifies modern strategies in fragment-based drug discovery, a hot topic in medicinal chemistry. Online forums and scientific databases frequently feature discussions on optimizing its synthesis or exploring novel derivatives.

In summary, 3'-Acetamidobiphenyl-3-carboxylic acid (CAS No. 893737-78-5) represents a versatile tool for researchers across disciplines. Its dual functionality and adaptability to diverse chemical transformations underscore its importance in cutting-edge science, from drug development to smart materials. As innovation accelerates, this compound will likely remain a focal point in both industrial and academic research.

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