cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid

Base Information

• Chemical Name: cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid
• CAS No.: 307989-03-3
• Molecular Formula: C₂₆H₃₁F₃N₂O₄
• Molecular Weight: 492.538
• Mol file: 307989-03-3.mol

Synonyms:cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid

Chemical Property of cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid

There total 7 articles about cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]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:

trans-4-[(4-tert-butylcyclohexylamino)methyl]benzoic acid methyl ester + 1-isocyanato-4-trifluoromethoxy-benzene (35037-73-1) → cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid (307989-03-3)

Guidance literature:

With sodium hydroxide; In ethanol; n-heptane; ethyl acetate; acetonitrile;

Reference yield:

cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid methyl ester → cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid (307989-03-3)

Guidance literature:

With sodium hydroxide; ethanol; at 50 ℃; for 3h;

DOI:10.1021/jm058026u

Reference yield:

cis-4-[(4-tert-butylcyclohexylamino)methyl]benzoic acid methyl ester (307988-99-4) → cis-4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoic acid (307989-03-3)

Guidance literature:

Multi-step reaction with 2 steps

1: acetonitrile / 16 h / 20 °C

2: aq. NaOH; ethanol / 3 h / 50 °C

With sodium hydroxide; ethanol; In acetonitrile;

DOI:10.1021/jm058026u

upstream raw materials:

cis-4-[(4-tert-butylcyclohexylamino)methyl]benzoic acid methyl ester

4-(trifluoromethoxy)aniline hydrochloride

4-tert-butylcyclohexylamine

Methyl 4-(bromomethyl)benzoate

Downstream raw materials:

cis-3-{4-[1-(4-tert-butylcyclohexyl)-3-(4-trifluoromethoxyphenyl)ureidomethyl]benzoylamino}propionic acid