- Design and synthesis of triazolopyrimidine acylsulfonamides as novel anti-mycobacterial leads acting through inhibition of acetohydroxyacid synthasePatil, Vikas; Kale, Manoj; Raichurkar, Anandkumar; Bhaskar, Brahatheeswaran; Prahlad, Dwarakanath; et al, Bioorganic & Medicinal Chemistry Letters, 2014, 24(9), 2222-2225
Cas no 89599-01-9 (3-Bromobenzenesulfonamide)
3-Bromobenzenesulfonamide Chemical and Physical Properties
Names and Identifiers
-
- 3-Bromobenzenesulphonamide
- m-bromobenzenesulfonamide
- 3-Bromobenzenesulfonamide
- 3-Bromo-benzenesulfonamide
- 3-Bromobenzene-1-Sulfonamide
- benzenesulfonamide, 3-bromo-
- 3-bromanylbenzenesulfonamide
- PubChem11759
- 3-bromophenylsulfonamide
- 3-BROMO-BENZENESULFONIC ACID AMIDE
- 3-bromobenzene sulfonamide
- 3-bromobenzene-sulfonamide
- 3-BROMOBENESULFONAMIDE
- KSC492S2B
- MUBJNMWVQGHHLG-UHFFFAOYSA-N
- 3-Bromobenzenesulfonamide (ACI)
- Benzenesulfonamide, m-bromo- (7CI)
- 3-(Aminosulfonyl)-bromobenzene
- 3-Sulfamoyl-1-bromobenzene
- 3-Bromobenzenesulfonamide, 97%
- AB03164
- B5734
- EN300-124454
- DB-013633
- MFCD00084903
- 89599-01-9
- 3-bromobenzene-1-sulphonamide
- SCHEMBL264103
- CS-W004130
- STL555734
- PS-3032
- A843244
- BBL101937
- J-200053
- DTXSID80370490
- AN-652/43422937
- Z45415621
- AKOS000147474
- TCMDC-123819
- SY010674
- CHEMBL531249
- A836786
-
- MDL: MFCD00084903
- Inchi: 1S/C6H6BrNO2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,(H2,8,9,10)
- InChI Key: MUBJNMWVQGHHLG-UHFFFAOYSA-N
- SMILES: O=S(C1C=C(Br)C=CC=1)(N)=O
Computed Properties
- Exact Mass: 234.93000
- Monoisotopic Mass: 234.93
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 221
- 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: 1.4
- Topological Polar Surface Area: 68.5
- Surface Charge: 0
- Tautomer Count: nothing
Experimental Properties
- Color/Form: solid
- Density: 1.754
- Melting Point: 156.0 to 160.0 deg-C
- Boiling Point: 375.8°C at 760 mmHg
- Flash Point: 181.1℃
- PSA: 68.54000
- LogP: 2.87760
- Solubility: Not determined
3-Bromobenzenesulfonamide Security Information
-
Symbol:
- Prompt:warning
- Signal Word:warning
- Hazard Statement: H315-H319
- Warning Statement: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
- Hazardous Material transportation number:NONH for all modes of transport
- WGK Germany:3
- Hazard Category Code: R36/37/38
- Safety Instruction: S37/39-S26
-
Hazardous Material Identification:
- HazardClass:IRRITANT
- Risk Phrases:R36/37/38
- Storage Condition:Store at 4°C,-4At ℃Store…Better
3-Bromobenzenesulfonamide Customs Data
- HS CODE:2935009090
- Customs Data:
China Customs Code:
2935009090Overview:
2935009090 Other sulphonates(Acyl)amine. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:35.0%
Declaration elements:
Product Name, component content, use to
Summary:
2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%
3-Bromobenzenesulfonamide Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 034627-1g |
3-Bromobenzenesulfonamide |
89599-01-9 | 97% | 1g |
£10.00 | 2022-03-01 | |
| Fluorochem | 034627-5g |
3-Bromobenzenesulfonamide |
89599-01-9 | 97% | 5g |
£18.00 | 2022-03-01 | |
| Fluorochem | 034627-25g |
3-Bromobenzenesulfonamide |
89599-01-9 | 97% | 25g |
£57.00 | 2022-03-01 | |
| Fluorochem | 034627-100g |
3-Bromobenzenesulfonamide |
89599-01-9 | 97% | 100g |
£205.00 | 2022-03-01 | |
| TI XI AI ( SHANG HAI ) HUA CHENG GONG YE FA ZHAN Co., Ltd. | B5734-25G |
3-Bromobenzenesulfonamide |
89599-01-9 | >98.0%(GC) | 25g |
¥990.00 | 2024-04-15 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B139406-1g |
3-Bromobenzenesulfonamide |
89599-01-9 | ≥97% | 1g |
¥39.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B139406-25g |
3-Bromobenzenesulfonamide |
89599-01-9 | ≥97% | 25g |
¥390.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B139406-5g |
3-Bromobenzenesulfonamide |
89599-01-9 | ≥97% | 5g |
¥106.90 | 2023-09-04 | |
| Alichem | A019089245-25g |
3-Bromobenzenesulphonamide |
89599-01-9 | 97% | 25g |
$354.32 | 2023-08-31 | |
| Alichem | A019089245-100g |
3-Bromobenzenesulphonamide |
89599-01-9 | 97% | 100g |
$354.90 | 2023-08-31 |
3-Bromobenzenesulfonamide Production Method
Production Method 1
Production Method 2
- Unexpected C=N bond formation via NaI-catalyzed oxidative de-tetra-hydrogenative cross-couplings between N,N-dimethyl aniline and sulfamidesZheng, Yang; Mao, Jincheng; Chen, Jie; Rong, Guangwei; Liu, Defu; et al, RSC Advances, 2015, 5(62), 50113-50117
Production Method 3
1.2 Reagents: Hydrochloric acid Solvents: Water
- Chemoselective Cleavage of Acylsulfonamides and Sulfonamides by Aluminum HalidesSang, Dayong ; Dong, Bingqian; Liu, Yunfeng; Tian, Juan, Journal of Organic Chemistry, 2022, 87(5), 3586-3595
Production Method 4
- Photocatalytic Late-Stage Functionalization of Sulfonamides via Sulfonyl Radical IntermediatesTilby, Michael J.; Dewez, Damien F.; Pantaine, Loic R. E.; Hall, Adrian; Martinez-Lamenca, Carolina; et al, ACS Catalysis, 2022, 12(10), 6060-6067
Production Method 5
- Design and Synthesis of Benzenesulfonamide Derivatives as Potent Anti-Influenza Hemagglutinin InhibitorsTang, Guozhi; Lin, Xianfeng; Qiu, Zongxing; Li, Wentao; Zhu, Lei; et al, ACS Medicinal Chemistry Letters, 2011, 2(8), 603-607
3-Bromobenzenesulfonamide Raw materials
3-Bromobenzenesulfonamide Preparation Products
3-Bromobenzenesulfonamide Related Literature
-
M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
-
2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
-
S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
Additional information on 3-Bromobenzenesulfonamide
Comprehensive Overview of 3-Bromobenzenesulfonamide (CAS No. 89599-01-9): Properties, Applications, and Industry Insights
3-Bromobenzenesulfonamide (CAS No. 89599-01-9) is a specialized organic compound widely utilized in pharmaceutical intermediates, agrochemical synthesis, and material science research. This brominated sulfonamide derivative exhibits unique chemical properties, making it a valuable building block for advanced molecular designs. With the growing demand for high-purity sulfonamide compounds in drug discovery, researchers are increasingly focusing on optimizing its synthetic pathways and exploring novel applications.
The molecular structure of 3-Bromobenzenesulfonamide features a benzene ring substituted with both a bromine atom at the meta position and a sulfonamide functional group. This configuration contributes to its enhanced reactivity in nucleophilic substitution reactions, particularly in the development of biologically active molecules. Recent studies highlight its potential as a key intermediate for antimicrobial agents and enzyme inhibitors, aligning with current industry trends toward targeted therapeutics.
In material science, 89599-01-9 demonstrates promising characteristics for polymer modification and surface functionalization. Its ability to form stable hydrogen bonds through the sulfonamide group makes it suitable for creating advanced functional materials with tailored properties. Researchers are investigating its role in developing self-assembling monolayers and molecular recognition systems, addressing the growing need for smart materials in nanotechnology applications.
The synthesis of 3-Bromobenzenesulfonamide typically involves bromination of benzenesulfonamide derivatives under controlled conditions. Modern green chemistry approaches are being applied to improve yield and reduce environmental impact, responding to the pharmaceutical industry's sustainability initiatives. Analytical techniques such as HPLC purity testing and spectroscopic characterization ensure compliance with stringent quality standards required for research and industrial applications.
Market analysis indicates rising demand for halogenated sulfonamides like 3-Bromobenzenesulfonamide, driven by expanding applications in medicinal chemistry and material engineering. Regulatory considerations emphasize proper handling procedures and storage conditions to maintain compound stability. As research continues to uncover new potential uses, this compound remains at the forefront of specialty chemical innovation, offering solutions for complex scientific challenges across multiple disciplines.
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