Description

4-Bromo-N-isopropylbenzamide (CAS: 336182-29-7) is a high-purity brominated benzamide derivative with the molecular formula C₁₀H₁₂BrNO. This compound is a versatile intermediate in organic synthesis and pharmaceutical research, offering excellent reactivity for coupling reactions and functional group transformations. With a molecular weight of 242.11 g/mol, it is supplied as a white to off-white crystalline powder with ≥98% purity (HPLC). Ideal for medicinal chemistry applications, it serves as a key building block for developing biologically active molecules, including kinase inhibitors and other small-molecule therapeutics. Store under inert conditions at 2-8°C to ensure long-term stability.

Properties

• CAS Number: 336182-29-7
• Complexity: 174
• IUPAC Name: 4-bromo-N-isopropyl-benzamide
• InChI: InChI=1S/C10H12BrNO/c1-7(2)12-10(13)8-3-5-9(11)6-4-8/h3-7H,1-2H3,(H,12,13)
• InChI Key: PWXNCWKINUCUPV-UHFFFAOYSA-N
• Exact Mass: 241.01023
• Molecular Formula: C10H12BrNO
• Molecular Weight: 242.11
• SMILES: CC(C)NC(=O)C1=CC=C(C=C1)Br
• Topological: 29.1
• Monoisotopic Mass: 241.01023
• Synonyms: 4-Bromo-N-isopropylbenzamide, 336182-29-7, DTXSID70394746, DTXCID60345606, N-Isopropyl 4-bromobenzamide, 4-bromo-N-propan-2-ylbenzamide, MFCD00465197, SCHEMBL13062204, PWXNCWKINUCUPV-UHFFFAOYSA-N, 4-Bromo-N-(1-methylethyl)benzamide, AKOS000172292, BS-28053, CS-0197159, 10.14272/PWXNCWKINUCUPV-UHFFFAOYSA-N, E78479, 10.14272/PWXNCWKINUCUPV-UHFFFAOYSA-N.1, doi:10.14272/PWXNCWKINUCUPV-UHFFFAOYSA-N, doi:10.14272/PWXNCWKINUCUPV-UHFFFAOYSA-N.1

4-Bromo-N-isopropylbenzamide is widely used as a synthetic intermediate in pharmaceutical and agrochemical research. It is particularly valuable in Suzuki-Miyaura cross-coupling reactions to introduce aryl bromine functionalities into complex molecules. Researchers utilize it in the development of kinase inhibitors and other bioactive compounds due to its reactive bromo group. Its isopropylamide moiety also enhances solubility in organic solvents, facilitating downstream derivatization.

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