Cas no 1238854-13-1 (5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole)
5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole is a brominated pyrazole derivative with significant utility in organic synthesis and pharmaceutical research. Its key structural features—a bromomethyl group at the 5-position and a 4-bromophenyl substituent at the 3-position—make it a versatile intermediate for further functionalization, particularly in cross-coupling reactions and heterocyclic scaffold construction. The presence of reactive bromine atoms facilitates selective modifications, enabling applications in medicinal chemistry for the development of bioactive compounds. This compound is particularly valued for its stability under standard handling conditions and its compatibility with a range of synthetic methodologies, offering researchers a reliable building block for complex molecular architectures.
1238854-13-1 structure
Product Name:5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole
CAS No:1238854-13-1
MF:C10H8Br2N2
MW:315.991920471191
CID:1029520
PubChem ID:71627139
Update Time:2025-06-09
5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole Chemical and Physical Properties
Names and Identifiers
-
- 5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole
- DTXSID10856515
- DB-062193
- 1238854-13-1
-
- Inchi: 1S/C10H8Br2N2/c11-6-9-5-10(14-13-9)7-1-3-8(12)4-2-7/h1-5H,6H2,(H,13,14)
- InChI Key: FGZKXARZJWYBAM-UHFFFAOYSA-N
- SMILES: BrCC1=CC(C2C=CC(=CC=2)Br)=NN1
Computed Properties
- Exact Mass: 315.90337g/mol
- Monoisotopic Mass: 313.90542g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 181
- 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: 3.2
- Topological Polar Surface Area: 28.7?2
5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A049003250-1g |
5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole |
1238854-13-1 | 95% | 1g |
$400.00 | 2023-09-03 | |
| Chemenu | CM125938-1g |
5-(bromomethyl)-3-(4-bromophenyl)-1H-pyrazole |
1238854-13-1 | 95% | 1g |
$356 | 2021-08-05 | |
| Chemenu | CM125938-1g |
5-(bromomethyl)-3-(4-bromophenyl)-1H-pyrazole |
1238854-13-1 | 95% | 1g |
$*** | 2023-04-03 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1763100-1g |
5-(Bromomethyl)-3-(4-bromophenyl)-1h-pyrazole |
1238854-13-1 | 98% | 1g |
¥2720.00 | 2024-08-09 |
5-(Bromomethyl)-3-(4-bromophenyl)-1H-pyrazole Related Literature
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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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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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