(2-(4-chlorophenyl)-4,4-diMethylcyclohex-1-enyl)Methanol

Base Information

• Chemical Name: (2-(4-chlorophenyl)-4,4-diMethylcyclohex-1-enyl)Methanol
• CAS No.: 1228780-51-5
• Molecular Formula: C₁₅H₁₉ClO
• Molecular Weight: 250.768
• Mol file: 1228780-51-5.mol

Synonyms:(4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methanol

Chemical Property of (2-(4-chlorophenyl)-4,4-diMethylcyclohex-1-enyl)Methanol

Chemical Property:

• Boiling Point: 359.0±35.0 °C(Predicted)
• PKA: 14.85±0.10(Predicted)
• Density: 1.095±0.06 g/cm3(Predicted)

Purity/Quality:

99% ^*data from raw suppliers

(2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-enyl)methanol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of (2-(4-chlorophenyl)-4,4-diMethylcyclohex-1-enyl)Methanol

There total 10 articles about (2-(4-chlorophenyl)-4,4-diMethylcyclohex-1-enyl)Methanol 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: 100.0%

4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-carboxylic acid methyl ester (1228780-49-1) → (4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methanol (1228780-51-5)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 4h; Inert atmosphere;

Reference yield: 75.0%

4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-carbaldehyde (1228837-05-5) → (4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methanol (1228780-51-5)

Guidance literature:

With methanol; sodium tetrahydroborate; at 0 - 5 ℃; for 1h;

Reference yield:

methyl 4,4-dimethyl-2-(((trifluoromethyl)sulfonyl)oxy)cyclohex-1-ene-1-carboxylate (1228780-46-8) → (4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methanol (1228780-51-5)

Guidance literature:

Multi-step reaction with 2 steps

1: cesium fluoride / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,2-dimethoxyethane; methanol / 24 h / 70 °C

2: lithium borohydride; methanol / diethyl ether / 24 h / 20 °C

With methanol; lithium borohydride; cesium fluoride; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In methanol; 1,2-dimethoxyethane; diethyl ether;

upstream raw materials:

4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-carboxylic acid methyl ester

methyl 4,4-dimethyl-2-oxocyclohexancarboxylate

methyl 4,4-dimethyl-2-(((trifluoromethyl)sulfonyl)oxy)cyclohex-1-ene-1-carboxylate

4-Chlorophenylboronic acid

Downstream raw materials:

methyl 2-bromo-4-(4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl]piperazin-1-yl)benzoate

1-((4’-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1‘-biphenyl]-2-yl)methyl)piperazine

2-((1H-pyrrolo[2,3-b]pyridin-5-yl)oxy)-4-(4-((4’-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1’-biphenyl]-2-yl)methyl)piperazin-1-yl)benzoic acid methyl ester

[2-((1H-pyrrolo [2,3-b]pyridin-5-yl)oxy)-4-(4-((4’-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1’-biphenyl]-2-yl)methyl)piperazin-1-yl)benzoic acid]