Description

Isopropyl 5-bromo-2-chlorobenzamide (CAS No. 849898-48-2) is a high-purity benzamide derivative with the molecular formula C₁₀H₁₁BrClNO. This compound, also known by its IUPAC name 5-bromo-2-chloro-N-propan-2-ylbenzamide, is a versatile intermediate in organic synthesis and pharmaceutical research. Its unique halogenated structure makes it valuable for cross-coupling reactions, such as Suzuki-Miyaura and Buchwald-Hartwig couplings, enabling the construction of complex aromatic frameworks. The isopropyl amide moiety enhances solubility in organic solvents, facilitating its use in medicinal chemistry applications. Supplied as a white to off-white crystalline solid with ≥95% purity (HPLC), this reagent is rigorously tested for quality and stability. Each batch is accompanied by comprehensive analytical data, including ¹H NMR, ¹³C NMR, and mass spectrometry reports. Suitable for research scale applications, it is packaged under inert atmosphere in amber glass vials with PTFE-lined caps to ensure long-term stability. Store at 2-8°C in a dry environment.

Properties

• CAS Number: 849898-48-2
• Complexity: 210
• IUPAC Name: 5-bromo-2-chloro-N-isopropyl-benzamide
• InChI: InChI=1S/C10H11BrClNO/c1-6(2)13-10(14)8-5-7(11)3-4-9(8)12/h3-6H,1-2H3,(H,13,14)
• InChI Key: DBQZPGFQOYCJGZ-UHFFFAOYSA-N
• Exact Mass: 274.97125
• Molecular Formula: C10H11BrClNO
• Molecular Weight: 276.56
• SMILES: CC(C)NC(=O)C1=C(C=CC(=C1)Br)Cl
• Topological: 29.1
• Monoisotopic Mass: 274.97125
• Synonyms: 849898-48-2, 5-Bromo-2-chloro-N-isopropylbenzamide, ISOPROPYL 5-BROMO-2-CHLOROBENZAMIDE, 5-bromo-2-chloro-N-propan-2-ylbenzamide, MFCD05853708, SCHEMBL29092068, DTXSID40406567, AKOS008916088, CR-0060, DB-343130, 5-bromo-2-chloro-N-(propan-2-yl)benzamide, CS-0154000, D82553, Z27645572

Application

This benzamide derivative serves as a key building block in pharmaceutical development, particularly for creating kinase inhibitors and GPCR modulators. Its bromo and chloro substituents enable precise functionalization via palladium-catalyzed reactions. Researchers utilize it as a precursor in the synthesis of agrochemicals and bioactive molecules. The compound has shown utility in structure-activity relationship (SAR) studies of antimicrobial agents.

If you are interested or have any questions, please contact us at support@atomfair.com

Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.