(Trifluorosilyl)methyl 4-bromobenzoate

Base Information

• Chemical Name: (Trifluorosilyl)methyl 4-bromobenzoate
• CAS No.: 76240-93-2
• Molecular Formula: C8H6BrF3O2Si
• Molecular Weight: 299.119
• DSSTox Substance ID: DTXSID10504120
• Mol file: 76240-93-2.mol

Synonyms:(Trifluorosilyl)methyl 4-bromobenzoate;76240-93-2;DTXSID10504120;(4-bromobenzoyloxymethyl)-trifluorosilane

Chemical Property of (Trifluorosilyl)methyl 4-bromobenzoate

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 297.92725
• Heavy Atom Count: 15
• Complexity: 226

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(=O)OC[Si](F)(F)F)Br

Technology Process of (Trifluorosilyl)methyl 4-bromobenzoate

There total 3 articles about (Trifluorosilyl)methyl 4-bromobenzoate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.5%

(4-bromobenzoyloxymethyl)triethoxysilane (57361-36-1) → (4-bromobenzoyloxymethyl)trifluorosilane (76240-93-2)

Guidance literature:

With sulfur tetrafluoride; at 20 ℃; for 20h;

DOI:10.1016/S0022-328X(00)92574-9

Reference yield:

potassium 4-bromobenzoate (51550-68-6) → (4-bromobenzoyloxymethyl)trifluorosilane (76240-93-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 50 percent / dimethylformamide / 0.33 h / Heating

2: 98.5 percent / SF₄ / 20 h / 20 °C

With sulfur tetrafluoride; In N,N-dimethyl-formamide;

DOI:10.1016/S0022-328X(00)92574-9

Reference yield:

→ (4-bromobenzoyloxymethyl)trifluorosilane (76240-93-2)

Guidance literature:

upstream raw materials:

(4-bromobenzoyloxymethyl)triethoxysilane

potassium 4-bromobenzoate