3-Fluoro-5-(trifluoromethyl)benzoic acid

Base Information

• Chemical Name: 3-Fluoro-5-(trifluoromethyl)benzoic acid
• CAS No.: 161622-05-5
• Molecular Formula: C8H4F4O2
• Molecular Weight: 208.112
• Hs Code.: 29163990
• Mol file: 161622-05-5.mol

Synonyms:3-Fluoro-5-(trifluoromethyl)benzoic acid

Chemical Property of 3-Fluoro-5-(trifluoromethyl)benzoic acid

Chemical Property:

• Appearance/Colour: white crystal powder
• Vapor Pressure: 0.0216mmHg at 25°C
• Melting Point: 104 °C
• Boiling Point: 239.6 °C at 760 mmHg
• PKA: 3.43±0.10(Predicted)
• Flash Point: 98.7 °C
• PSA: 37.30000
• Density: 1.489 g/cm³
• LogP: 2.54270
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Solubility.: soluble in Methanol

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-Fluoro-5-(trifluoromethyl)benzoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Technology Process of 3-Fluoro-5-(trifluoromethyl)benzoic acid

There total 1 articles about 3-Fluoro-5-(trifluoromethyl)benzoic acid 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:

3-fluoro-5-trifluoromethyl-benzonitrile (149793-69-1) → 3-fluoro-5-(trifluoromethyl)benzoic acid (161622-05-5)

Guidance literature:

With sodium hydroxide; In water; at 85 - 90 ℃; for 2h;

Reference yield: 97.0%

[2-(2-thyenyl)ethyl]amine (30433-91-1) + 3-fluoro-5-(trifluoromethyl)benzoic acid (161622-05-5) → C14H11F4NOS (1370339-91-5)

Guidance literature:

With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; triethylamine; In dichloromethane; acetonitrile; at 20 ℃;

DOI:10.1016/j.ejmech.2012.08.041

Reference yield: 95.0%

1-(2-Naphthyl)ethylamine (1201-74-7,3082-62-0,3906-16-9,64234-21-5) + 3-fluoro-5-(trifluoromethyl)benzoic acid (161622-05-5) → C20H15F4NO (1415400-93-9)

Guidance literature:

With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; triethylamine; In dichloromethane; acetonitrile; at 20 ℃;

DOI:10.1016/j.ejmech.2012.08.041

upstream raw materials:

3-fluoro-5-trifluoromethyl-benzonitrile

Downstream raw materials:

3-fluoro-N-methoxy-N-methyl-5-(trifluoromethyl)benzamide

tert-butyl 4-fluoro-4-((3-fluoro-5-(trifluoromethyl)benzamido)methyl)piperidine-1-carboxylate

(5-chloro-2-hydroxyphenyl)[3-fluoro-5-(trifluoromethyl)phenyl]methanone

(5-chloro-2-methoxyphenyl)[3-fluoro-5-(trifluoromethyl)phenyl]methanone

Refernces