3-(Bromomethyl)-2-fluorobenzoicacid

Base Information

• Chemical Name: 3-(Bromomethyl)-2-fluorobenzoicacid
• CAS No.: 680610-75-7
• Molecular Formula: C8H6BrFO2
• Molecular Weight: 233.03400
• Hs Code.: 2931900090
• Mol file: 680610-75-7.mol

Synonyms:

Chemical Property of 3-(Bromomethyl)-2-fluorobenzoicacid

Chemical Property:

• Boiling Point: 328.8±32.0 °C(Predicted)
• PKA: 3.15±0.10(Predicted)
• PSA: 37.30000
• Density: 1.717±0.06 g/cm3(Predicted)
• LogP: 2.41880

Purity/Quality:

95% ^*data from raw suppliers

3-(Bromomethyl)-2-fluorobenzoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-(Bromomethyl)-2-fluorobenzoicacid

There total 2 articles about 3-(Bromomethyl)-2-fluorobenzoicacid 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:

2-fluoro-3-methylbenzoic acid (315-31-1) → 3-(bromomethyl)-2-fluorobenzoic acid (680610-75-7)

Guidance literature:

With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); In acetonitrile; at 20 ℃; for 12h; Reflux;

Reference yield:

methyl 3-(bromomethyl)-2-fluorobenzoate (171670-20-5) → 3-(bromomethyl)-2-fluorobenzoic acid (680610-75-7) + 2-fluoro-3-(hydroxymethyl)benzoic acid (481075-37-0)

Guidance literature:

With water; In methanol; Alkaline conditions;

DOI:10.1016/j.bmcl.2009.05.054

Reference yield:

3-(bromomethyl)-2-fluorobenzoic acid (680610-75-7) + C7H3F3N2OS*C4H9NO → 3-(((3-cyano-6-oxo-4-(trifluoromethyl)-1,6-dihydropyridin-2-yl)thio)methyl)-2-fluorobenzoic acid

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dimethyl sulfoxide; at 20 ℃; for 1h;

upstream raw materials:

methyl 3-(bromomethyl)-2-fluorobenzoate

2-fluoro-3-methylbenzoic acid

Downstream raw materials:

C₂₈H₂₇BrFNO₅S

Refernces

• 1、 Chang, Dong-Jo,Yoon, Eun-Young,Lee, Geon-Bong,Kim, Soon-Ok,Kim, Wan-Joo,Kim, Young-Myeong,Jung, Jong-Wha,An, Hongchan,Suh, Young-Ger. "Design, synthesis and identification of novel colchicine-derived immunosuppressant". scheme or table. p. 4416 - 4420. Retrieved 2010/04/05.