Cas no 1360963-03-6 (4-bromo-5-methyl-1H-1,3-benzodiazole)
4-Bromo-5-methyl-1H-1,3-benzodiazole is a heterocyclic organic compound featuring a benzodiazole core substituted with a bromine atom at the 4-position and a methyl group at the 5-position. This structure makes it a valuable intermediate in pharmaceutical and agrochemical synthesis, particularly for the development of biologically active molecules. The bromine substituent enhances reactivity in cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings, enabling efficient derivatization. Its methyl group contributes to steric and electronic modulation, influencing binding affinity in target applications. The compound is characterized by high purity and stability, ensuring reliable performance in synthetic workflows. Suitable for research and industrial-scale applications, it offers versatility in medicinal chemistry and material science.
1360963-03-6 structure
Product Name:4-bromo-5-methyl-1H-1,3-benzodiazole
CAS No:1360963-03-6
MF:C8H7BrN2
MW:211.058580636978
CID:4593205
PubChem ID:86767409
Update Time:2025-06-15
4-bromo-5-methyl-1H-1,3-benzodiazole Chemical and Physical Properties
Names and Identifiers
-
- 4-bromo-5-methyl-1H-1,3-benzodiazole
- 4-bromo-5-methyl-1H-benzimidazole
- 4-Bromo-5-methylbenzimidazole
- 4-Bromo-5-methyl-1H-benzo[d]imidazole
-
- Inchi: 1S/C8H7BrN2/c1-5-2-3-6-8(7(5)9)11-4-10-6/h2-4H,1H3,(H,10,11)
- InChI Key: ILQTVYOOUXZJHF-UHFFFAOYSA-N
- SMILES: BrC1=C(C)C=CC2=C1N=CN2
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 151
- XLogP3: 2.5
- Topological Polar Surface Area: 28.7
4-bromo-5-methyl-1H-1,3-benzodiazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B813170-5mg |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 5mg |
$ 70.00 | 2022-06-06 | ||
| TRC | B813170-10mg |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 10mg |
$ 95.00 | 2022-06-06 | ||
| TRC | B813170-50mg |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 50mg |
$ 340.00 | 2022-06-06 | ||
| A2B Chem LLC | AW12649-2.5g |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 95% | 2.5g |
$2805.00 | 2024-04-20 | |
| A2B Chem LLC | AW12649-5g |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 95% | 5g |
$4134.00 | 2024-04-20 | |
| A2B Chem LLC | AW12649-50mg |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 95% | 50mg |
$364.00 | 2024-04-20 | |
| A2B Chem LLC | AW12649-100mg |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 95% | 100mg |
$526.00 | 2024-04-20 | |
| A2B Chem LLC | AW12649-250mg |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 95% | 250mg |
$737.00 | 2024-04-20 | |
| A2B Chem LLC | AW12649-500mg |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 95% | 500mg |
$1137.00 | 2024-04-20 | |
| A2B Chem LLC | AW12649-1g |
4-bromo-5-methyl-1H-1,3-benzodiazole |
1360963-03-6 | 95% | 1g |
$1449.00 | 2024-04-20 |
4-bromo-5-methyl-1H-1,3-benzodiazole Related Literature
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
1360963-03-6 (4-bromo-5-methyl-1H-1,3-benzodiazole) Related Products
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
- 1449132-38-0(3-Fluoro-5-(2-fluoro-5-methylbenzylcarbamoyl)benzeneboronic acid)
- 2034271-14-0(2-(1H-indol-3-yl)-N-{[6-(thiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide)
Recommended suppliers
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
CN Supplier
Bulk
Zouping Mingyuan Import and Export Trading Co., Ltd
Gold Member
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
CN Supplier
Reagent
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Gold Member
CN Supplier
Reagent
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Gold Member
CN Supplier
Reagent