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Sodium 1-(trifluoromethyl)cyclopropanesulfinate
产品别名
Sodium 1-(trifluoromethyl)cyclopropanesulfinate
Baran TFCS-Na Reagent
结构式
基本信息
| Empirical Formula【经验(实验)分子式】 | C4H4F3NaO2S |
| Molecular weight | 196.12 |
| MDL number | MFCD28124332 |
| PubChem Substance ID【PubChem化学物质编号】 | 329768203 |
| NACRES | NA.22 |
| Application【应用】 | TFCS-Na is a diversification reagent for the C-H Functionalization of several classes of heterocycles. This reagent installs the trifluoromethylcyclopropyl group, which was recently reported to increase metabolic stability compared to compounds containing the tert-butyl group. Simple Sulfinate Synthesis Enables C-H Trifluoromethylcyclopropanation |
产品性质
| reaction suitability | reagent type: catalyst reaction type: C-H Activation |
| Quality Level【质量水平】 | 100 |
| mp | 287-292 ℃ |
| SMILES string | [O-]S(C1(CC1)C(F)(F)F)=O.[Na+] |
| InChI | 1S/C4H5F3O2S.Na/c5-4(6,7)3(1-2-3)10(8)9;/h1-2H2,(H,8,9);/q;+1/p-1 |
| InChI key | IZLDENBRBYPDNY-UHFFFAOYSA-M |
| packaging【包装】 | 5 g in glass bottle 500 mg in amber glass bottle |
安全信息
| Pictograms【象形图】 | GHS07 |
| Signal word【警示用语：】 | Warning |
| Hazard Statements | H315 - H319 - H335 |
| Precautionary Statements | P302 + P352 - P305 + P351 + P338 |
| Hazard Classifications【危险分类】 | Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3 |
| Target Organs【靶器官】 | Respiratory system |
| Storage Class Code【储存分类代码】 | 11 - Combustible Solids |
| WGK | WGK 3 |
