Cas no 2383774-80-7 (3-Fluoro-6-iodo-2-methylbenzonitrile)
3-Fluoro-6-iodo-2-methylbenzonitrile is a halogenated aromatic compound featuring a nitrile group, fluorine, and iodine substituents on a methyl-substituted benzene ring. Its distinct structure makes it a valuable intermediate in organic synthesis, particularly in pharmaceutical and agrochemical applications. The presence of both fluorine and iodine offers versatility for further functionalization via cross-coupling reactions, such as Suzuki or Sonogashira couplings. The electron-withdrawing nitrile group enhances reactivity in nucleophilic substitution reactions. This compound’s well-defined regiochemistry and stability under standard conditions ensure consistent performance in complex synthetic pathways. It is commonly utilized in the development of bioactive molecules and advanced materials.
2383774-80-7 structure
Product Name:3-Fluoro-6-iodo-2-methylbenzonitrile
CAS No:2383774-80-7
MF:C8H5FIN
MW:261.034877538681
MDL:MFCD32703352
CID:5327695
PubChem ID:154845403
Update Time:2025-05-27
3-Fluoro-6-iodo-2-methylbenzonitrile Chemical and Physical Properties
Names and Identifiers
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- 3-Fluoro-6-iodo-2-methylbenzonitrile
- Z3325972309
-
- MDL: MFCD32703352
- Inchi: 1S/C8H5FIN/c1-5-6(4-11)8(10)3-2-7(5)9/h2-3H,1H3
- InChI Key: WBSRMZJGXRZBEA-UHFFFAOYSA-N
- SMILES: IC1=CC=C(C(C)=C1C#N)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 186
- XLogP3: 2.8
- Topological Polar Surface Area: 23.8
3-Fluoro-6-iodo-2-methylbenzonitrile Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-26980474-0.05g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 0.05g |
$101.0 | 2025-02-19 | |
| Enamine | EN300-26980474-0.1g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 0.1g |
$152.0 | 2025-02-19 | |
| Enamine | EN300-26980474-0.25g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 0.25g |
$216.0 | 2025-02-19 | |
| Enamine | EN300-26980474-0.5g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 0.5g |
$407.0 | 2025-02-19 | |
| Enamine | EN300-26980474-1.0g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 1.0g |
$528.0 | 2025-02-19 | |
| Enamine | EN300-26980474-2.5g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 2.5g |
$1034.0 | 2025-02-19 | |
| Enamine | EN300-26980474-5.0g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 5.0g |
$1530.0 | 2025-02-19 | |
| Enamine | EN300-26980474-10.0g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95.0% | 10.0g |
$2269.0 | 2025-02-19 | |
| Enamine | EN300-26980474-1g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95% | 1g |
$528.0 | 2023-09-11 | |
| Enamine | EN300-26980474-5g |
3-fluoro-6-iodo-2-methylbenzonitrile |
2383774-80-7 | 95% | 5g |
$1530.0 | 2023-09-11 |
3-Fluoro-6-iodo-2-methylbenzonitrile Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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