Cas no 349096-38-4 (N-Benzyl-N-isopropyl-3-methylbenzamide)

N-Benzyl-N-isopropyl-3-methylbenzamide is a synthetic benzamide derivative characterized by its unique structural features, including a benzyl and isopropyl substituent on the nitrogen atom and a methyl group at the meta position of the benzamide ring. This compound is of interest in organic and medicinal chemistry due to its potential as an intermediate in the synthesis of pharmacologically active molecules. Its well-defined molecular structure allows for precise modifications, making it valuable for structure-activity relationship studies. The compound exhibits moderate stability under standard conditions, facilitating handling and storage. Its lipophilic properties may enhance membrane permeability, suggesting utility in drug discovery applications. Further research is required to fully elucidate its reactivity profile and potential applications.
N-Benzyl-N-isopropyl-3-methylbenzamide structure
349096-38-4 structure
Product Name:N-Benzyl-N-isopropyl-3-methylbenzamide
CAS No:349096-38-4
MF:C18H21NO
MW:267.365444898605
CID:1466799
PubChem ID:2843429
Update Time:2025-10-30

N-Benzyl-N-isopropyl-3-methylbenzamide Chemical and Physical Properties

Names and Identifiers

    • N-Benzyl-N-isopropyl-3-methylbenzamide
    • N-Benzyl-N-isopropyl-3-MethylbenzaMide, 97%
    • STL221459
    • N-benzyl-3-methyl-N-(propan-2-yl)benzamide
    • AKOS003276243
    • 349096-38-4
    • starbld0022291
    • N-benzyl-3-methyl-N-propan-2-ylbenzamide
    • AB00082834-01
    • Inchi: 1S/C18H21NO/c1-14(2)19(13-16-9-5-4-6-10-16)18(20)17-11-7-8-15(3)12-17/h4-12,14H,13H2,1-3H3
    • InChI Key: HALAOZZIEMLHQL-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=C(C)C=1)N(CC1C=CC=CC=1)C(C)C

Computed Properties

  • Exact Mass: 267.162314293g/mol
  • Monoisotopic Mass: 267.162314293g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 4
  • Complexity: 307
  • 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: 4
  • Topological Polar Surface Area: 20.3?2

Experimental Properties

  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 430.7±34.0 °C at 760 mmHg
  • Flash Point: 196.9±16.9 °C
  • Vapor Pressure: 0.0±1.0 mmHg at 25°C

N-Benzyl-N-isopropyl-3-methylbenzamide Security Information

N-Benzyl-N-isopropyl-3-methylbenzamide Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
AN HUI ZE SHENG Technology Co., Ltd.
H59205-250mg
N-Benzyl-N-isopropyl-3-methylbenzamide, 97%
349096-38-4 97%
250mg
¥1614.00 2023-09-15
AN HUI ZE SHENG Technology Co., Ltd.
H59205-1g
N-Benzyl-N-isopropyl-3-methylbenzamide, 97%
349096-38-4 97%
1g
¥5167.00 2023-09-15

Additional information on N-Benzyl-N-isopropyl-3-methylbenzamide

N-Benzyl-N-isopropyl-3-methylbenzamide: A Comprehensive Overview

The compound N-Benzyl-N-isopropyl-3-methylbenzamide (CAS No. 349096-38-4) is a versatile organic compound with significant applications in various fields, including pharmaceuticals, agrochemicals, and materials science. Its unique structure, characterized by a benzamide core with substituents at the 3-methyl position, makes it a valuable intermediate in organic synthesis. Recent advancements in synthetic methodologies have further enhanced its utility, particularly in the development of bioactive compounds and advanced materials.

N-Benzyl-N-isopropyl-3-methylbenzamide is synthesized through a combination of nucleophilic acyl substitution and alkylation reactions. The benzamide group serves as a reactive site for further functionalization, enabling the incorporation of diverse substituents. This flexibility has been exploited in the design of novel drugs targeting various therapeutic areas, such as cancer and neurodegenerative diseases. For instance, recent studies have demonstrated its potential as a scaffold for developing inhibitors of histone deacetylases (HDACs), which are implicated in epigenetic regulation.

In the context of agrochemicals, N-Benzyl-N-isopropyl-3-methylbenzamide has been utilized as a precursor for herbicides and fungicides. Its ability to modulate enzyme activity in plant pathogens has made it a focus of research in sustainable agriculture. Emerging research highlights its role in enhancing crop resilience against environmental stressors, such as drought and temperature fluctuations.

From a materials science perspective, N-Benzyl-N-isopropyl-3-methylbenzamide has been explored as a building block for polyamides and other high-performance polymers. Its aromatic structure contributes to thermal stability and mechanical strength, making it suitable for applications in aerospace and electronics. Recent breakthroughs in polymer synthesis have leveraged its unique properties to develop lightweight yet durable materials.

The latest studies on N-Benzyl-N-isopropyl-3-methylbenzamide also emphasize its role in green chemistry. Researchers have developed catalytic systems that enable its synthesis under mild conditions, reducing environmental impact. These advancements align with global efforts to promote sustainable chemical processes.

In conclusion, N-Benzyl-N-isopropyl-3-methylbenzamide (CAS No. 349096-38-4) stands as a testament to the interdisciplinary nature of modern chemistry. Its diverse applications and ongoing research underscore its importance as a key compound in contemporary chemical science.

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