Cas no 10557-73-0 (4-Bromo-5-phenylisoxazole)
4-Bromo-5-phenylisoxazole is a halogenated isoxazole derivative with significant utility in organic synthesis and pharmaceutical research. Its bromine substituent enhances reactivity, making it a versatile intermediate for cross-coupling reactions, such as Suzuki or Sonogashira couplings, enabling the construction of complex heterocyclic frameworks. The phenyl group contributes to structural diversity, facilitating applications in medicinal chemistry for the development of bioactive compounds. This compound exhibits stability under standard conditions, ensuring reliable handling and storage. Its well-defined structure and high purity make it suitable for precise synthetic applications, particularly in the design of novel isoxazole-based therapeutics or agrochemicals.
4-Bromo-5-phenylisoxazole structure
Product Name:4-Bromo-5-phenylisoxazole
CAS No:10557-73-0
MF:C9H6BrNO
MW:224.054041385651
CID:1156028
PubChem ID:14361579
Update Time:2025-10-28
4-Bromo-5-phenylisoxazole Chemical and Physical Properties
Names and Identifiers
-
- Isoxazole, 4-bromo-5-phenyl-
- 4-bromo-5-phenyl-1,2-oxazole
- 10557-73-0
- DTXSID60559367
- 4-Bromo-5-phenylisoxazole, AldrichCPR
- 4-bromo-5-phenylisoxazole
- 4-Bromo-5-phenylisoxazole
-
- Inchi： 1S/C9H6BrNO/c10-8-6-11-12-9(8)7-4-2-1-3-5-7/h1-6H
- InChI Key： OPNQYKVNIGKUAF-UHFFFAOYSA-N
- SMILES： BrC1C=NOC=1C1C=CC=CC=1
Computed Properties
- Exact Mass: 222.96328
- Monoisotopic Mass: 222.96328g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 148
- 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: 2.7
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.03
4-Bromo-5-phenylisoxazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B998275-10mg |
4-Bromo-5-phenylisoxazole |
10557-73-0 | 10mg |
$ 58.00 | 2023-04-18 | ||
| TRC | B998275-50mg |
4-Bromo-5-phenylisoxazole |
10557-73-0 | 50mg |
$ 213.00 | 2023-04-18 | ||
| TRC | B998275-100mg |
4-Bromo-5-phenylisoxazole |
10557-73-0 | 100mg |
$ 316.00 | 2023-04-18 | ||
| TRC | B998275-25mg |
4-Bromo-5-phenylisoxazole |
10557-73-0 | 25mg |
$ 1349.00 | 2023-04-18 |
4-Bromo-5-phenylisoxazole Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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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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