Introduction：Basic information about 3-(Trifluoromethyl)benzyl bromide CAS 402-23-3, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
3-(Trifluoromethyl)benzyl bromide Basic information
| Product Name: | 3-(Trifluoromethyl)benzyl bromide |
| Synonyms: | 3-(Bromomethyl)benzotrifluoride, 1-(Bromomethyl)-3-(trifluoromethyl)benzene;ALPHA'-BROMO-ALPHA,ALPHA,ALPHA-TRIFLUORO-M-XYLENE;ALPHA-BROMO-ALPHA',ALPHA',ALPHA'-TRIFLUORO-M-XYLENE;A'-BROMO-A,A,A-TRIFLUORO-M-XYLENE;3-(TRIFLUOROMETHYL)BENZYL BROMIDE;3-(BROMOMETHYL)BENZOTRIFLUORIDE;3-(TrifluoroMethyl)broMide;3-(Bromomethyl)benzotrifluoridealpha-Bromo-alpha',alpha',alpha'-trifluoro-m-xylene |
| CAS: | 402-23-3 |
| MF: | C8H6BrF3 |
| MW: | 239.03 |
| EINECS: | 206-938-9 |
| Product Categories: | Aromatic Halides (substituted);Miscellaneous;Fluoro-contained benzyl bromide series;Benzenes;Benzyl;Aromatics;Miscellaneous Reagents;Halogenated Heterocycles ,Pyrimidines |
| Mol File: | 402-23-3.mol |
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3-(Trifluoromethyl)benzyl bromide Chemical Properties
| Boiling point | 69 °C/4 mmHg (lit.) |
| density | 1.565 g/mL at 25 °C (lit.) |
| refractive index | n20/D 1.492(lit.) |
| Fp | 190 °F |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| form | clear liquid |
| color | Colorless to Almost colorless |
| Specific Gravity | 1.565 |
| Sensitive | Lachrymatory |
| BRN | 743243 |
| InChI | 1S/C8H6BrF3/c9-5-6-2-1-3-7(4-6)8(10,11)12/h1-4H,5H2 |
| InChIKey | MYYYZNVAUZVXBO-UHFFFAOYSA-N |
| SMILES | FC(F)(F)c1cccc(CBr)c1 |
| CAS DataBase Reference | 402-23-3(CAS DataBase Reference) |
| NIST Chemistry Reference | 3-Trifluoromethylbenzyl bromide(402-23-3) |
Safety Information
| Hazard Codes | C,Xi |
| Risk Statements | 34 |
| Safety Statements | 26-36/37/39-45-25 |
| RIDADR | UN 3265 8/PG 2 |
| WGK Germany | 3 |
| Hazard Note | Corrosive/Lachrymatory |
| HazardClass | 8 |
| PackingGroup | III |
| HS Code | 29039990 |
| Storage Class | 8A - Combustible corrosive hazardous materials |
| Hazard Classifications | Skin Corr. 1B |
3-(Trifluoromethyl)benzyl bromide Usage And Synthesis
| Chemical Properties | Colorless to light yellow liqui |
| Uses | Used in the preparation of 1-benzylazetidine-3-carboxylic acid derivatives as agonists and antagonists of the S1P5 receptor. |
| Uses | 3-(Trifluoromethyl)benzyl bromide has been used in the preparation of flocoumafen. |
3-(Trifluoromethyl)benzyl bromide Preparation Products And Raw materials
| Raw materials | (3-(Trifluoromethyl)phenyl)magnesium bromide, 0.25 M in THF-->3-METHYLBENZOTRIFLUORIDE-->3-(Trifluoromethyl)benzyl alcohol-->3-(Trifluoromethyl)benzaldehyde |
| Preparation Products | 3-(Trifluoromethyl)benzylamine-->2-{[3-(trifluoromethyl)benzyl]oxy}benzoic acid-->3-(TRIFLUOROMETHYL)BENZYL THIOCYANATE |
