3-Fluoro-4-iodobenzonitrile
- CAS No.
- 887266-99-1
- Chemical Name:
- 3-Fluoro-4-iodobenzonitrile
- Synonyms
- CAS:887266-99-1;Fluoro-4-ioxynil;5-Fluoro-4-iodobenzonitrile;4-Cyano-2-fluoroiodobenzene;3-FLUORO-4-IODOBENZONITRILE3;Benzonitrile, 3-fluoro-4-iodo-
- CBNumber:
- CB8501194
- Molecular Formula:
- C7H3FIN
- Molecular Weight:
- 247.01
- MDL Number:
- MFCD07782076
- MOL File:
- 887266-99-1.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Melting point | 113-117 °C |
|---|---|
| Boiling point | 268℃ |
| Density | 1.98 |
| Flash point | 116℃ |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| form | powder to crystal |
| color | Light yellow to Brown |
| Sensitive | Light Sensitive |
| InChI | 1S/C7H3FIN/c8-6-3-5(4-10)1-2-7(6)9/h1-3H |
| InChIKey | NPKQMCCUPXZXFI-UHFFFAOYSA-N |
| SMILES | Fc1cc(ccc1I)C#N |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |   GHS05,GHS07 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Danger | |||||||||
| Hazard statements | H302-H315-H318-H335 | |||||||||
| Precautionary statements | P280-P301+P312+P330-P302+P352-P305+P351+P338+P310 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Gloves | |||||||||
| Hazard Codes | Xi,Xn | |||||||||
| Risk Statements | 22-37/38-41 | |||||||||
| Safety Statements | 26-39 | |||||||||
| WGK Germany | 3 | |||||||||
| Hazard Note | Harmful | |||||||||
| HazardClass | IRRITANT, IRRITANT-HARMFUL | |||||||||
| HS Code | 29269090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Acute Tox. 4 Oral Eye Dam. 1 Skin Irrit. 2 STOT SE 3 |
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| NFPA 704 |
|
3-Fluoro-4-iodobenzonitrile price More Price(39)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Sigma-Aldrich | 678899 | 3-Fluoro-4-iodobenzonitrile 97% | 887266-99-1 | 1g | $87.7 | 2026-04-30 | Buy |
| TCI Chemical | F1093 | 3-Fluoro-4-iodobenzonitrile >98.0%(GC) | 887266-99-1 | 1g | $73 | 2026-04-30 | Buy |
| Biosynth | FF67909 | 3-Fluoro-4-iodobenzonitrile | 887266-99-1 | 50g | $150 | 2026-06-04 | Buy |
| Biosynth | FF67909 | 3-Fluoro-4-iodobenzonitrile | 887266-99-1 | 10g | $150 | 2026-06-04 | Buy |
| Activate Scientific | AS26591 | 3-Fluoro-4-iodobenzonitrile 95% | 887266-99-1 | 5g | $30 | 2026-06-04 | Buy |
3-Fluoro-4-iodobenzonitrile Chemical Properties, Uses, Production
Uses
3-Fluoro-4-iodobenzonitrile is a halocarbon compound, mainly used as a chemical and pharmaceutical intermediate.
Chemical Properties
Type of white crystal
Synthesis
63069-50-1
887266-99-1
The general procedure for the synthesis of 3-fluoro-4-iodobenzonitrile from 3-fluoro-4-aminobenzonitrile was as follows: a mixture of 4-amino-3-fluorobenzonitrile (5.0 g, 36.76 mmol) with 4-toluenesulfonic acid (20.0 g, 105.2 mmol) in acetonitrile (50 mL) was stirred for 4 hours at room temperature. Subsequently, an aqueous solution of NaNO2 (3.8 g, 55.07 mmol) and KI (9.15 g, 55.07 mmol) was slowly added at 0 °C and stirring was continued for 1 hour. After completion of the reaction, the reaction mixture was quenched with ice water, washed sequentially with aqueous NaHSO3 and extracted with EtOAc. The organic layer was washed with water and brine, dried with Na2SO4 and concentrated under reduced pressure to give 4.0 g of the target product 3-fluoro-4-iodobenzonitrile. The product was characterized by 1H NMR (300 MHz, CDCl3): δ 7.94-7.89 (t, J = 8.4 Hz, 1H), 7.34-7.32 (d, J = 7.5 Hz, 1H), 7.21-7.19 (d, J = 8.1 Hz, 1H).
References
[1] Patent: WO2016/55947, 2016, A1. Location in patent: Page/Page column 57
[2] Bioorganic and Medicinal Chemistry Letters, 2018, vol. 28, # 23-24, p. 3766 - 3773
3-Fluoro-4-iodobenzonitrile Preparation Products And Raw materials
Raw materials
Preparation Products
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 | jkinfo@jkchemical.com | China | 96815 | 76 |
| Alfa Aesar | 400-6106006 | saleschina@alfa-asia.com | China | 30103 | 84 |
| Shijiazhuang Sdyano Fine Chemical Co., Ltd. | 0311-89250318 13582355795 | master@sjzsdyn.com | China | 2776 | 65 |
| Wuhan Chemwish Technology Co., Ltd | 86-027-67849912 | sales@chemwish.com | China | 35884 | 56 |
| Capot Chemical Co., Ltd | +86 (0) 571 85 58 67 18 | China | 18187 | 66 | |
| Beijing Ouhe Technology Co., Ltd | 13552068683 13522913783 | 2355560935@qq.com | China | 11777 | 60 |
| JinYan Chemicals(ShangHai) Co.,Ltd. | 13817811078 | sales@jingyan-chemical.com | China | 9963 | 60 |
| Shanghai Sinch Parmaceuticals Tech. Co. Ltd. | +86-21-54098501 | sales@sinch.com.cn | China | 11592 | 64 |
| Jia Xing Isenchem Co.,Ltd | 0573-85285100 18627885956 | isenchem@163.com | China | 9389 | 66 |
| Shanghai Harvest Chemical Industrial Co., Ltd. | 15721252604 17321035817 | sales@harvest-chem.com | China | 2829 | 64 |
View Latest Price from 3-Fluoro-4-iodobenzonitrile manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2020-01-13 | 3-FLUORO-4-IODOBENZONITRILE
887266-99-1
|
$1.00 | 1g | 99% | 10000KGS | Career Henan Chemical Co |
-
- 3-FLUORO-4-IODOBENZONITRILE
887266-99-1
- $1.00
- 99%
- Career Henan Chemical Co
