3-Bromo-5-cyanobenzotrifluoride
- CAS No.
- 691877-03-9
- Chemical Name:
- 3-Bromo-5-cyanobenzotrifluoride
- Synonyms
- 3-Bromo-5-cyanobenzotrifluoride;3-Bromo-5-(trifluoromethyl)benzonitrile;3-bromo-3-(trifluoromethyl)benzonitrile;Benzonitrile, 3-bromo-5-(trifluoromethyl)-;3-Bromo-5-(trifluoromethyl)benzonitrile98%;3-Bromo-5-cyanobenzotrifluoride, 5-Bromo-alpha,alpha,alpha-trifluoro-m-tolunitrile
- CBNumber:
- CB41114836
- Molecular Formula:
- C8H3BrF3N
- Molecular Weight:
- 250.02
- MDL Number:
- MFCD09800708
- MOL File:
- 691877-03-9.mol
- MSDS File:
- SDS
| Boiling point | 216.0±35.0 °C(Predicted) |
|---|---|
| Density | 1.71±0.1 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly), Ethyl Acetate (Slightly) |
| form | Oil |
| color | Colourless |
| InChI | InChI=1S/C8H3BrF3N/c9-7-2-5(4-13)1-6(3-7)8(10,11)12/h1-3H |
| InChIKey | KZFVJLGAVFCPAZ-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC(C(F)(F)F)=CC(Br)=C1 |
3-Bromo-5-cyanobenzotrifluoride price
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| Apolloscientific | PC5486 | 3-Bromo-5-(trifluoromethyl)benzonitrile 98% | 691877-03-9 | 1g | $21 | 2026-06-04 | Buy |
| Apolloscientific | PC5486 | 3-Bromo-5-(trifluoromethyl)benzonitrile 98% | 691877-03-9 | 5g | $35 | 2026-06-04 | Buy |
| Apolloscientific | PC5486 | 3-Bromo-5-(trifluoromethyl)benzonitrile 98% | 691877-03-9 | 25g | $41 | 2026-06-04 | Buy |
| Activate Scientific | AS25345 | 3-Bromo-5-(trifluoromethyl)benzonitrile 97% | 691877-03-9 | 1g | $20 | 2026-06-04 | Buy |
| Activate Scientific | AS25345 | 3-Bromo-5-(trifluoromethyl)benzonitrile 97% | 691877-03-9 | 5g | $33 | 2026-06-04 | Buy |
3-Bromo-5-cyanobenzotrifluoride Chemical Properties, Uses, Production
Chemical Properties
colorless to light yellow liquid
Synthesis
1007578-83-7
691877-03-9
General procedure for the synthesis of 3-bromo-5-trifluoromethylbenzonitrile from 3-bromo-5-(trifluoromethyl)benzamide: 3-bromo-5-(trifluoromethyl)benzamide (420 mg, 1.56 mmol) and 2,4,6-trichloro-1,3,5-triazine (437 mg, 2.35 mmol) were dissolved in N,N-dimethylformamide (DMF, 4 mL). The reaction was stirred at room temperature overnight. A white precipitate was observed during the reaction. Upon completion of the reaction, water (10 mL) was added to the mixture and extracted with ethyl acetate (EA, 20 mL × 2). The organic phases were combined, washed with saturated saline (30 mL), dried over anhydrous sodium sulfate (Na2SO4), filtered and concentrated under reduced pressure to afford the target compound 3-bromo-5-trifluoromethylbenzonitrile (330 mg, 84% yield) as a brown oil. Its nuclear magnetic resonance hydrogen spectrum (1H NMR, 400 MHz, CDCl3) data were as follows: δ 7.99 (s, 1H), 7.98 (s, 1H), 7.85 (s, 1H).
References
[1] Patent: WO2014/206344, 2014, A1. Location in patent: Page/Page column 75; 76
3-Bromo-5-cyanobenzotrifluoride Preparation Products And Raw materials
Raw materials
Preparation Products
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Shanghai Harvest Chemical Industrial Co., Ltd. | 15721252604 17321035817 | sales@harvest-chem.com | China | 2829 | 64 |
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 | jkinfo@jkchemical.com | China | 96815 | 76 |
| Energy Chemical | 400-0056266 | sales8178@energy-chemical.com | China | 44850 | 61 |
| 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 | |
| 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 |
| Adamas Reagent, Ltd. | 400-6009262 15618770481 | yhx@titansci.com | China | 14098 | 59 |
View Latest Price from 3-Bromo-5-cyanobenzotrifluoride manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2019-12-20 | 3-Bromo-5-cyanobenzotrifluoride
691877-03-9
|
$1.00 | 1g | 99.99% | 2tons | Career Henan Chemical Co |
-
- 3-Bromo-5-cyanobenzotrifluoride
691877-03-9
- $1.00
- 99.99%
- Career Henan Chemical Co
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