Cas no 1261677-85-3 (Benzamide, 3-bromo-2-(bromomethyl)-)

Benzamide, 3-bromo-2-(bromomethyl)- is a brominated aromatic compound featuring reactive bromomethyl and bromo substituents on the benzene ring. This structure makes it a valuable intermediate in organic synthesis, particularly for introducing bromoalkyl functionalities in pharmaceutical and agrochemical applications. The dual bromination enhances its utility in cross-coupling reactions and nucleophilic substitutions, enabling precise molecular modifications. Its crystalline form ensures consistent purity, facilitating reproducible results in research and industrial processes. The compound’s stability under controlled conditions allows for safe handling and storage, while its defined reactivity profile supports its use in constructing complex heterocyclic frameworks.
Benzamide, 3-bromo-2-(bromomethyl)- structure
1261677-85-3 structure
Product Name:Benzamide, 3-bromo-2-(bromomethyl)-
CAS No:1261677-85-3
MF:C8H7Br2NO
MW:292.955280542374
CID:2129812
Update Time:2025-11-07

Benzamide, 3-bromo-2-(bromomethyl)- Chemical and Physical Properties

Names and Identifiers

    • 3-bromo-2-(bromomethyl)Benzamide
    • CID 129959417
    • Benzamide, 3-bromo-2-(bromomethyl)-
    • Inchi: 1S/C8H7Br2NO/c9-4-6-5(8(11)12)2-1-3-7(6)10/h1-3H,4H2,(H2,11,12)
    • InChI Key: FEHSWKIXYTXEJI-UHFFFAOYSA-N
    • SMILES: BrC1=CC=CC(C(N)=O)=C1CBr

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 174
  • Topological Polar Surface Area: 43.1

Experimental Properties

  • Density: 1.904±0.06 g/cm3(Predicted)
  • Boiling Point: 340.8±37.0 °C(Predicted)
  • pka: 15.10±0.50(Predicted)

Benzamide, 3-bromo-2-(bromomethyl)- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
A015001664-250mg
3-Bromo-2-(bromomethyl)benzamide
1261677-85-3 97%
250mg
$480.00 2023-09-03
Alichem
A015001664-500mg
3-Bromo-2-(bromomethyl)benzamide
1261677-85-3 97%
500mg
$863.90 2023-09-03
Alichem
A015001664-1g
3-Bromo-2-(bromomethyl)benzamide
1261677-85-3 97%
1g
$1460.20 2023-09-03

Additional information on Benzamide, 3-bromo-2-(bromomethyl)-

Comprehensive Overview of Benzamide, 3-bromo-2-(bromomethyl)- (CAS No. 1261677-85-3): Properties, Applications, and Industry Insights

Benzamide, 3-bromo-2-(bromomethyl)- (CAS No. 1261677-85-3) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research due to its unique structural features. This brominated derivative of benzamide exhibits distinct reactivity patterns, making it a valuable intermediate in synthetic chemistry. With the rising demand for halogenated compounds in drug discovery, 3-bromo-2-(bromomethyl)benzamide has emerged as a key building block for designing bioactive molecules targeting various therapeutic areas.

The molecular structure of Benzamide, 3-bromo-2-(bromomethyl)- incorporates two strategically positioned bromine atoms, which enhance its utility in cross-coupling reactions such as Suzuki-Miyaura and Buchwald-Hartwig animations. Recent studies highlight its role in developing kinase inhibitors and antimicrobial agents, aligning with current industry trends toward precision medicine. Researchers are particularly interested in its potential to modify drug solubility and metabolic stability—two critical parameters in modern pharmaceutical formulation.

From an environmental perspective, the synthesis and handling of CAS 1261677-85-3 adhere to stringent green chemistry principles, addressing growing concerns about sustainable manufacturing. Innovations in catalytic bromination methods have reduced waste generation during its production, responding to the chemical industry's sustainability goals. These advancements resonate with the increasing search queries for "eco-friendly synthetic routes" and "halogenation process optimization" across scientific databases.

Analytical characterization of 3-bromo-2-(bromomethyl)benzamide typically involves advanced techniques like HPLC-MS and NMR spectroscopy, topics frequently searched by quality control professionals. The compound's crystalline properties and stability under various pH conditions make it suitable for formulation development, particularly in solid-dosage forms. This aligns with pharmaceutical developers' searches for "excipient compatibility studies" and "API degradation analysis."

In material science, derivatives of Benzamide, 3-bromo-2-(bromomethyl)- have shown promise in creating photoactive materials for organic electronics—a hot topic in renewable energy research. Its ability to participate in polymer functionalization reactions answers frequent queries about "conductive polymer modifiers" and "OLED precursor synthesis." These applications position CAS No. 1261677-85-3 at the intersection of multiple cutting-edge technologies.

Regulatory compliance remains a critical consideration for users of this compound. While not classified as hazardous under standard protocols, proper laboratory safety measures must be observed—a subject of recurring searches like "handling brominated compounds safely." Documentation for CAS 1261677-85-3 typically includes detailed spectral data and certificates of analysis, which are essential for regulatory submissions and frequently requested by procurement specialists.

The commercial availability of Benzamide, 3-bromo-2-(bromomethyl)- through specialty chemical suppliers has expanded significantly, reflecting its growing industrial adoption. Current market analyses indicate rising interest in "custom bromination services" and "small-scale API intermediates," with this compound serving as a representative example. Its shelf-life stability and compatibility with common organic solvents further enhance its practicality for diverse research applications.

Future research directions for CAS No. 1261677-85-3 may explore its utility in bioconjugation chemistry or as a precursor for PET radiotracers—areas generating substantial academic interest. As synthetic methodologies evolve, this compound's role in facilitating C-H functionalization reactions could answer emerging search trends about "direct arylation techniques" in medicinal chemistry. These potential applications underscore the compound's enduring relevance in scientific innovation.

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