Cas no 79839-66-0 (N-Diisopropyl 2-bromobenzamide)
N-Diisopropyl 2-bromobenzamide Chemical and Physical Properties
Names and Identifiers
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- 2-Bromo-N,N-diisopropylbenzamide
- 2-bromo-N,N-di(propan-2-yl)benzamide
- Benzamide,2-bromo-N,N-bis(1-methylethyl)-
- N-Diisopropyl 2-bromobenzamide
- N,N-diisopropyl-2-bromobenzamide
- o-bromo-N,N-diisopropylbenzamide
- AKOS003853688
- A864798
- DTXSID30357014
- MFCD00583268
- CS-0211093
- 79839-66-0
- N,N-Diisopropyl 2-Bromobenzamide
- SCHEMBL4077020
- BS-23753
- STL176383
- AK-968/40004101
-
- MDL： MFCD00583268
- Inchi： 1S/C13H18BrNO/c1-9(2)15(10(3)4)13(16)11-7-5-6-8-12(11)14/h5-10H,1-4H3
- InChI Key： CFGJWHGKVALRSD-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1C(N(C(C)C)C(C)C)=O
Computed Properties
- Exact Mass: 283.05700
- Monoisotopic Mass: 283.05718g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 232
- 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: 3.7
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- Density: 1.2±0.1 g/cm3
- Melting Point: NA
- Boiling Point: 364.6±25.0 °C at 760 mmHg
- Flash Point: 174.3±23.2 °C
- PSA: 20.31000
- LogP: 3.70810
- Vapor Pressure: 0.0±0.8 mmHg at 25°C
N-Diisopropyl 2-bromobenzamide Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
N-Diisopropyl 2-bromobenzamide Customs Data
- HS CODE：2924299090
- Customs Data：
China Customs Code:
2924299090Overview:
2924299090. Other cyclic amides(Including cyclic carbamates)(Including their derivatives as well as their salts). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to, packing
Summary:
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
N-Diisopropyl 2-bromobenzamide Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | D493508-100mg |
N-Diisopropyl 2-bromobenzamide |
79839-66-0 | 100mg |
$64.00 | 2023-05-18 | ||
| TRC | D493508-250mg |
N-Diisopropyl 2-bromobenzamide |
79839-66-0 | 250mg |
$75.00 | 2023-05-18 | ||
| TRC | D493508-500mg |
N-Diisopropyl 2-bromobenzamide |
79839-66-0 | 500mg |
$87.00 | 2023-05-18 | ||
| TRC | D493508-1g |
N-Diisopropyl 2-bromobenzamide |
79839-66-0 | 1g |
$98.00 | 2023-05-18 | ||
| TRC | D455355-500mg |
N,N-Diisopropyl 2-Bromobenzamide |
79839-66-0 | 500mg |
$ 115.00 | 2023-09-07 | ||
| TRC | D455355-1g |
N,N-Diisopropyl 2-Bromobenzamide |
79839-66-0 | 1g |
$ 138.00 | 2023-09-07 | ||
| TRC | D455355-5g |
N,N-Diisopropyl 2-Bromobenzamide |
79839-66-0 | 5g |
$ 471.00 | 2023-09-07 | ||
| TRC | D455355-1000mg |
N,N-Diisopropyl 2-Bromobenzamide |
79839-66-0 | 1g |
$138.00 | 2023-05-18 | ||
| eNovation Chemicals LLC | D509532-1g |
2-BroMo-N,N-diisopropylbenzaMide |
79839-66-0 | 97% | 1g |
$235 | 2023-09-03 | |
| eNovation Chemicals LLC | D509532-5g |
2-BroMo-N,N-diisopropylbenzaMide |
79839-66-0 | 97% | 5g |
$750 | 2023-09-03 |
N-Diisopropyl 2-bromobenzamide Suppliers
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N-Diisopropyl 2-bromobenzamide Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
Additional information on N-Diisopropyl 2-bromobenzamide
Recent Advances in the Study of N-Diisopropyl 2-bromobenzamide (CAS: 79839-66-0) and Its Applications in Chemical Biology and Pharmaceutical Research
N-Diisopropyl 2-bromobenzamide (CAS: 79839-66-0) is a brominated aromatic amide compound that has garnered significant attention in recent years due to its versatile applications in chemical biology and pharmaceutical research. This compound serves as a key intermediate in the synthesis of various bioactive molecules and has been explored for its potential in drug discovery and development. Recent studies have highlighted its role in the construction of complex molecular architectures, particularly in the context of kinase inhibitors and other therapeutic agents.
One of the most notable advancements in the study of N-Diisopropyl 2-bromobenzamide is its use in palladium-catalyzed cross-coupling reactions, such as the Suzuki-Miyaura and Buchwald-Hartwig reactions. These reactions are pivotal in the synthesis of biaryl and heteroaryl compounds, which are common scaffolds in many pharmaceuticals. A 2023 study published in the Journal of Medicinal Chemistry demonstrated the efficacy of this compound in the synthesis of novel kinase inhibitors, showing promising activity against cancer cell lines.
In addition to its synthetic utility, N-Diisopropyl 2-bromobenzamide has been investigated for its potential as a building block in the development of PROTACs (Proteolysis Targeting Chimeras). PROTACs are a groundbreaking class of therapeutics that target proteins for degradation via the ubiquitin-proteasome system. A recent preprint on bioRxiv detailed the use of this compound in the design of PROTACs targeting oncogenic proteins, showcasing its versatility in modern drug discovery paradigms.
Another area of interest is the compound's role in the development of fluorescent probes for biological imaging. Researchers have functionalized N-Diisopropyl 2-bromobenzamide to create probes that can selectively bind to specific cellular targets, enabling real-time visualization of biological processes. A 2022 study in ACS Chemical Biology reported the successful application of such probes in tracking protein-protein interactions in live cells, opening new avenues for studying cellular dynamics.
Despite these advancements, challenges remain in the large-scale synthesis and purification of N-Diisopropyl 2-bromobenzamide. Recent efforts have focused on optimizing reaction conditions to improve yield and purity, as highlighted in a 2023 patent application by a leading pharmaceutical company. These improvements are critical for ensuring the compound's reliability in industrial-scale applications.
In conclusion, N-Diisopropyl 2-bromobenzamide (CAS: 79839-66-0) continues to be a valuable tool in chemical biology and pharmaceutical research. Its applications span from synthetic chemistry to drug discovery and biological imaging, underscoring its importance in the field. Future research is expected to further explore its potential, particularly in the development of next-generation therapeutics and diagnostic tools.
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