4-Carboxy-2-iodobenzotrifluoride, 3-Iodo-alpha,alpha,alpha-trifluoro-p-toluic acid

Base Information

• Chemical Name: 4-Carboxy-2-iodobenzotrifluoride, 3-Iodo-alpha,alpha,alpha-trifluoro-p-toluic acid
• CAS No.: 1034690-61-3
• Molecular Formula: C8H4F3IO2
• Molecular Weight: 316.018
• Hs Code.: 2916399090
• Mol file: 1034690-61-3.mol

Synonyms:3-Iodo-4-(trifluoromethyl)benzoic acid;4-Carboxy-2-iodobenzotrifluoride, 3-Iodo-alpha,alpha,alpha-trifluoro-p-toluic acid

Chemical Property of 4-Carboxy-2-iodobenzotrifluoride, 3-Iodo-alpha,alpha,alpha-trifluoro-p-toluic acid

Chemical Property:

• PSA: 37.30000
• LogP: 3.00820

Purity/Quality:

98%min ^*data from raw suppliers

3-Iodo-4-(trifluoromethyl)benzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-Carboxy-2-iodobenzotrifluoride, 3-Iodo-alpha,alpha,alpha-trifluoro-p-toluic acid

There total 1 articles about 4-Carboxy-2-iodobenzotrifluoride, 3-Iodo-alpha,alpha,alpha-trifluoro-p-toluic 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-nitro-4-(trifluoromethyl)benzoic acid (116965-16-3) → 3-iodo-4-(trifluoromethyl)benzoic acid (1034690-61-3)

Guidance literature:

Multi-step reaction with 2 steps

1.1: hydrogen / palladium on activated charcoal / ethyl acetate / 2068.65 Torr

2.1: sulfuric acid; sodium nitrite / water / 1 h / -5 - 0 °C

2.2: 5 h / 20 °C / Heating / reflux

With sulfuric acid; hydrogen; sodium nitrite; palladium on activated charcoal; In water; ethyl acetate;

Reference yield:

3-iodo-4-(trifluoromethyl)benzoic acid (1034690-61-3) → C8H3ClF3IO

Guidance literature:

With oxalyl dichloride; N,N-dimethyl-formamide; In dichloromethane; at 0 - 20 ℃; for 3h;

DOI:10.1016/j.ejmech.2016.10.003

Reference yield:

3-iodo-4-(trifluoromethyl)benzoic acid (1034690-61-3) + ethyl 3-{5-[(hydroxyimino)(amino)methyl]-1H-indol-1-yl}propanoate (1034689-56-9) → ethyl 3-(5-{5-[3-iodo-4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-1H-indol-1-yl)propanoate (1034690-63-5)

Guidance literature:

3-iodo-4-(trifluoromethyl)benzoic acid; With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In N,N-dimethyl-formamide; at 20 ℃; for 0.25h;

ethyl 3-{5-[(hydroxyimino)(amino)methyl]-1H-indol-1-yl}propanoate; In N,N-dimethyl-formamide; at 20 ℃;

upstream raw materials:

3-nitro-4-(trifluoromethyl)benzoic acid

Downstream raw materials:

ethyl 3-(5-{5-[3-iodo-4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-3-yl}-1H-indol-1-yl)propanoate

Refernces