3-Chloro-4-fluorobenzotrifluoride
- CAS No.
- 78068-85-6
- Chemical Name:
- 3-Chloro-4-fluorobenzotrifluoride
- Synonyms
- 2-CHLORO-1-FLUORO-4-(TRIFLUOROMETHYL)BENZENE;3-chloro-4-fluorobezotrilfuoride;3-Cholor-4-Fluorobenzo-Trifluori;-Chloro-4-fluorobenzotrifluoride;3-CHLORO-4-FLUOROBENZOTRIFLUORIDE;3-chloro-4-fluorotrifluorotoluene;3-chloro-4-chlorobenzotrifluoride;3-CHOLOR-4-FLUOROBENZO-TRIFLUORIDE;3-chloro-4-fluorobenzontrifluoride;3-chloro-4-fluorobenzene trifluoro
- CBNumber:
- CB8409111
- Molecular Formula:
- C7H3ClF4
- Molecular Weight:
- 198.55
- MDL Number:
- MFCD00042207
- MOL File:
- 78068-85-6.mol
- MSDS File:
- SDS
- TDS File:
- TDS
| Boiling point | 137℃ |
|---|---|
| Density | 1,49 g/cm3 |
| refractive index | 1.4355 |
| Flash point | 42°(108°F) |
| storage temp. | Sealed in dry,2-8°C |
| solubility | Chloroform, Methanol |
| form | Oil |
| color | Clear Colorless |
| BRN | 4309386 |
| Henry's Law Constant | 2.4×10-4 mol/(m3Pa) at 25℃, Zhang et al. (2010) |
| InChI | InChI=1S/C7H3ClF4/c8-5-3-4(7(10,11)12)1-2-6(5)9/h1-3H |
| InChIKey | BKHVEYHSOXVAOP-UHFFFAOYSA-N |
| SMILES | C1(F)=CC=C(C(F)(F)F)C=C1Cl |
| CAS DataBase Reference | 78068-85-6(CAS DataBase Reference) |
| EPA Substance Registry System | Benzene, 2-chloro-1-fluoro-4-(trifluoromethyl)- (78068-85-6) |
SAFETY
Risk and Safety Statements
| Symbol(GHS) |   GHS07,GHS02 |
|||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Signal word | Warning | |||||||||
| Hazard statements | H227-H315-H319-H226-H335 | |||||||||
| Precautionary statements | P210-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501-P261-P280g-P305+P351+P338 | |||||||||
| Hazard Codes | Xi,Xn | |||||||||
| Risk Statements | 36/37/38-20/21/22 | |||||||||
| Safety Statements | 26-36 | |||||||||
| RIDADR | 1993 | |||||||||
| Hazard Note | Irritant | |||||||||
| TSCA | TSCA listed | |||||||||
| HazardClass | 3 | |||||||||
| PackingGroup | Ⅲ | |||||||||
| HS Code | 29039990 | |||||||||
| REACH Registrations | Active | |||||||||
| NFPA 704 |
|
3-Chloro-4-fluorobenzotrifluoride price More Price(42)
| Manufacturer | Product number | Product description | CAS number | Packaging | Price | Updated | Buy |
|---|---|---|---|---|---|---|---|
| TCI Chemical | C1515 | 3-Chloro-4-fluorobenzotrifluoride >98.0%(GC) | 78068-85-6 | 5g | $19 | 2026-04-30 | Buy |
| TCI Chemical | C1515 | 3-Chloro-4-fluorobenzotrifluoride >98.0%(GC) | 78068-85-6 | 25g | $64 | 2026-04-30 | Buy |
| Strem Chemicals | 09-1863 | 3-Chloro-4-fluorobenzotrifluoride, 98% 98% | 78068-85-6 | 10g | $265 | 2026-04-30 | Buy |
| Strem Chemicals | 09-1863 | 3-Chloro-4-fluorobenzotrifluoride, 98% 98% | 78068-85-6 | 50g | $1012 | 2026-04-30 | Buy |
| TRC | TRC-C584910-5G | 3-Chloro-4-fluorobenzotrifluoride | 78068-85-6 | 5g | $96 | 2026-06-03 | Buy |
3-Chloro-4-fluorobenzotrifluoride Chemical Properties,Uses,Production
Chemical Properties
Clear colorless liquid
Uses
3-Chloro-4-fluorobenzotrifluoride acts as a reagent in the synthesis of β-substituted 3-(4-aryloxyaryl)propanoic acid as GPR40 agonists.
Synthesis
328-84-7
78068-85-6
In a 500 mL four-neck flask equipped with a condenser, 200 mL of N,N-dimethylacetamide (DMA), 0.2 mol of 3,4-dichlorobenzotrifluoride, 1.0 mol of potassium fluoride, and 0.01 mol of tetraphenylphosphine chloride were added. The reaction mixture was heated to 150°C until the gas chromatography (GC) content of the feedstock 3,4-dichlorobenzotrifluoride was less than 1%. Upon completion of the reaction, potassium fluoride and catalyst were recovered by diafiltration for use in the next batch of the reaction. The mother liquor was dissolved and purified by distillation to give 3-chloro-4-fluorobenzotrifluoride in 99% purity and 90% yield.
References
[1] Patent: CN106554289, 2017, A. Location in patent: Paragraph 0025; 0026; 0027; 0030; 0031; 0032; 0035-0037
[2] Gazzetta Chimica Italiana, 1996, vol. 126, # 7, p. 457 - 462
3-Chloro-4-fluorobenzotrifluoride Preparation Products And Raw materials
Raw materials
Preparation Products
| Supplier | Tel | Country | ProdList | Advantage | |
|---|---|---|---|---|---|
| Nanjing webright Pharmaceutical Technology Co., Ltd | 18066048793; 18014498793 | 1504914633@qq.com | China | 1621 | 58 |
| J & K SCIENTIFIC LTD. | 18210857532 18210857532 | jkinfo@jkchemical.com | China | 96815 | 76 |
| future industrial shanghai co., ltd | 400-0066400 13621662912 | sales@jonln.com | China | 1989 | 65 |
| Alfa Aesar | 400-6106006 | saleschina@alfa-asia.com | China | 30103 | 84 |
| TCI (Shanghai) Development Co., Ltd. | 021-67121386 | Sales-CN@TCIchemicals.com | China | 24512 | 81 |
| Beijing HwrkChemical Technology Co., Ltd | 89508211 18501085097 | sales.bj@hwrkchemical.com | China | 9407 | 55 |
| Energy Chemical | 400-0056266 | sales8178@energy-chemical.com | China | 44850 | 61 |
| 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 |
View Lastest Price from 3-Chloro-4-fluorobenzotrifluoride manufacturers
| Image | Update time | Product | Price | Min. Order | Purity | Supply Ability | Manufacturer | |
|---|---|---|---|---|---|---|---|---|
 |
2026-06-30 | 3-Chloro-4-fluorobenzotrifluoride
78068-85-6
|
1KG | 99.0% | 10000KGS | Shaanxi Dideu New Materials Co. Ltd | ||
 |
2026-03-20 | 3-Chloro-4-fluorobenzotrifluoride
78068-85-6
|
$10.00 | 1KG | 99% | 10 mt | Hebei Chuanghai Biotechnology Co., Ltd | |
 |
2026-02-02 | 3-Chloro-4-fluorobenzotrifluoride
78068-85-6
|
50mg | 99%HPLC | 2000tons | Shaanxi Dideu Medichem Co. Ltd |
-
- 3-Chloro-4-fluorobenzotrifluoride
78068-85-6
- 99.0%
- Shaanxi Dideu New Materials Co. Ltd
-
- 3-Chloro-4-fluorobenzotrifluoride
78068-85-6
- $10.00
- 99%
- Hebei Chuanghai Biotechnology Co., Ltd
-
- 3-Chloro-4-fluorobenzotrifluoride
78068-85-6
- 99%HPLC
- Shaanxi Dideu Medichem Co. Ltd
