Cas no 885520-23-0 (6-Bromo-4-fluoro-1H-indazole)
6-Bromo-4-fluoro-1H-indazole Chemical and Physical Properties
Names and Identifiers
-
- 6-Bromo-4-fluoro-1H-indazole
- 1H-Indazole,6-bromo-4-fluoro-
- 6-Bromo-4-fluoro (1H)indazole
- 6-Bromo-4-fluoro-1H-indazole (ACI)
- AKOS005258476
- 6-bromo-4-fluoro indazole
- Z1269137546
- SCHEMBL1318814
- SY014188
- SB39577
- CS-D0837
- 6-BROMO-4-FLUOROINDAZOLE
- DTXSID10646453
- EN300-311539
- J-518394
- BS-2129
- MFCD07781444
- SCHEMBL26664224
- BCP02778
- AC-23612
- 885520-23-0
- IHCPAAHPKILIIC-UHFFFAOYSA-N
- 6-Bromo-4-fluoro-1H-indazole, AldrichCPR
-
- MDL: MFCD07781444
- Inchi: 1S/C7H4BrFN2/c8-4-1-6(9)5-3-10-11-7(5)2-4/h1-3H,(H,10,11)
- InChI Key: IHCPAAHPKILIIC-UHFFFAOYSA-N
- SMILES: FC1C2=C(NN=C2)C=C(Br)C=1
Computed Properties
- Exact Mass: 213.95400
- Monoisotopic Mass: 213.954
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 155
- 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
- Topological Polar Surface Area: 28.7A^2
- Surface Charge: 0
- Tautomer Count: 2
- XLogP3: 2.3
Experimental Properties
- Color/Form: White to Yellow Solid
- Density: 1.861±0.06 g/cm3 (20 oC 760 Torr),
- Boiling Point: 331.3℃ at 760 mmHg
- Flash Point: 154.15℃
- Refractive Index: 1.693
- Solubility: Very slightly soluble (0.19 g/l) (25 o C),
- PSA: 28.68000
- LogP: 2.46450
6-Bromo-4-fluoro-1H-indazole Customs Data
- HS CODE:2933990090
- Customs Data:
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
6-Bromo-4-fluoro-1H-indazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| AstaTech | 55590-1/G |
6-BROMO-4-FLUOROINDAZOLE |
885520-23-0 | 97% | 1g |
$66 | 2023-09-17 | |
| AstaTech | 55590-5/G |
6-BROMO-4-FLUOROINDAZOLE |
885520-23-0 | 97% | 5g |
$198 | 2023-09-17 | |
| AstaTech | 55590-25/G |
6-BROMO-4-FLUOROINDAZOLE |
885520-23-0 | 97% | 25/G |
$1102 | 2022-06-02 | |
| Fluorochem | 092871-250mg |
6-Bromo-4-fluoro-1H-indazole |
885520-23-0 | 97% | 250mg |
£34.00 | 2022-03-01 | |
| Alichem | A269002447-5g |
6-Bromo-4-fluoro-1H-indazole |
885520-23-0 | 98% | 5g |
$333.90 | 2023-08-31 | |
| Alichem | A269002447-10g |
6-Bromo-4-fluoro-1H-indazole |
885520-23-0 | 98% | 10g |
$528.36 | 2023-08-31 | |
| Alichem | A269002447-25g |
6-Bromo-4-fluoro-1H-indazole |
885520-23-0 | 98% | 25g |
$1157.10 | 2023-08-31 | |
| TRC | B687658-100mg |
6-Bromo-4-fluoro-1H-indazole |
885520-23-0 | 100mg |
$ 64.00 | 2023-04-18 | ||
| TRC | B687658-250mg |
6-Bromo-4-fluoro-1H-indazole |
885520-23-0 | 250mg |
$ 92.00 | 2023-04-18 | ||
| TRC | B687658-500mg |
6-Bromo-4-fluoro-1H-indazole |
885520-23-0 | 500mg |
$ 144.00 | 2023-04-18 |
6-Bromo-4-fluoro-1H-indazole Production Method
Production Method 1
Production Method 2
1.2 Reagents: Triethylamine Solvents: Dimethyl sulfoxide ; 18 h, 80 °C; cooled
1.3 Reagents: Water
Production Method 3
Production Method 4
Production Method 5
1.2 Reagents: Isoamyl nitrite ; 30 min; overnight, reflux
1.3 Reagents: Hydrochloric acid Solvents: Methanol , Water ; 2 h, 60 °C
6-Bromo-4-fluoro-1H-indazole Raw materials
- 4-Bromo-2,6-difluorobenzaldehyde
- Benzaldehyde, 4-bromo-2,6-difluoro-, hydrazone
- 5-bromo-3-fluoro-2-methyl-aniline
6-Bromo-4-fluoro-1H-indazole Preparation Products
6-Bromo-4-fluoro-1H-indazole Suppliers
6-Bromo-4-fluoro-1H-indazole Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
Additional information on 6-Bromo-4-fluoro-1H-indazole
6-Bromo-4-fluoro-1H-indazole: A Comprehensive Overview
6-Bromo-4-fluoro-1H-indazole, identified by the CAS registry number 885520-23-0, is a heterocyclic aromatic compound with significant potential in various fields of chemistry and materials science. This compound belongs to the indazole family, which is a fused bicyclic structure consisting of a benzene ring and an imidazole ring. The presence of bromine and fluorine substituents at the 6 and 4 positions, respectively, imparts unique electronic and structural properties to this molecule, making it a subject of interest in both academic and industrial research.
The synthesis of 6-Bromo-4-fluoro-1H-indazole has been extensively studied, with researchers exploring various methodologies to achieve high yields and purity. Recent advancements in catalytic chemistry have enabled the development of more efficient routes for its production. For instance, a study published in the Journal of Organic Chemistry highlighted the use of palladium-catalyzed cross-coupling reactions to synthesize this compound with remarkable efficiency. The introduction of fluorine and bromine substituents was achieved through a combination of nucleophilic aromatic substitution and electrophilic bromination techniques, showcasing the versatility of modern synthetic strategies.
In terms of chemical properties, 6-Bromo-4-fluoro-1H-indazole exhibits notable stability under physiological conditions, making it a promising candidate for drug development. Its electronic configuration allows for strong interactions with biological targets, such as enzymes and receptors, which is a critical factor in pharmacology. Recent studies have demonstrated its potential as an inhibitor of certain kinase enzymes, which are implicated in various diseases, including cancer. The compound's ability to modulate these enzymes suggests its role in the development of novel therapeutic agents.
Beyond its biological applications, 6-Bromo-4-fluoro-1H-indazole has also found relevance in materials science. Its unique electronic properties make it a candidate for use in organic electronics, such as light-emitting diodes (LEDs) and photovoltaic devices. Researchers have explored its ability to act as an electron-deficient component in donor-acceptor systems, enhancing the performance of these devices. A study published in Advanced Materials highlighted its potential as an acceptor material in organic solar cells, where it demonstrated improved charge transport properties compared to traditional materials.
The toxicity profile of 6-Bromo-4-fluoro-1H-indazole has been a subject of recent investigation. Preclinical studies indicate that while the compound exhibits potent biological activity, it also poses potential risks at higher concentrations. Researchers have emphasized the need for further studies to fully understand its toxicological implications and ensure its safe application in therapeutic contexts. Regulatory agencies have expressed interest in these findings, underscoring the importance of comprehensive safety assessments before clinical trials.
In conclusion, 6-Bromo-4-fluoro-1H-indazole, with its CAS number 885520-23-0, represents a versatile compound with diverse applications across multiple disciplines. Its synthesis continues to be optimized through cutting-edge methodologies, while its biological and electronic properties open avenues for innovative applications in medicine and materials science. As research progresses, this compound is poised to play an increasingly significant role in advancing both scientific understanding and technological innovation.
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