{(2S)-2-{Bis[3,5-bis(trifluoroMethyl)phenyl]hydroxyMethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]Methanone

Base Information

• Chemical Name: {(2S)-2-{Bis[3,5-bis(trifluoroMethyl)phenyl]hydroxyMethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]Methanone
• CAS No.: 951008-65-4
• Molecular Formula: C₃₁H₂₅F₁₂N₃O₂
• Molecular Weight: 699.539
• Mol file: 951008-65-4.mol

Synonyms:Chiral DMAP;

Chemical Property of {(2S)-2-{Bis[3,5-bis(trifluoroMethyl)phenyl]hydroxyMethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]Methanone

Chemical Property:

• PSA: 56.67000
• LogP: 8.30060

Purity/Quality:

{(2S)-2-{Bis[3,5-bis(trifluoromethyl)phenyl]hydroxymethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]methanone 97% ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of {(2S)-2-{Bis[3,5-bis(trifluoroMethyl)phenyl]hydroxyMethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]Methanone

There total 6 articles about {(2S)-2-{Bis[3,5-bis(trifluoroMethyl)phenyl]hydroxyMethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]Methanone 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: 95.0%

pyrrolidine (123-75-1) + C27H17N2O2ClF12 (951008-61-0) → {(2S)-2-{bis[3,5-bis(trifluoromethyl)phenyl]hydroxymethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]methanone (951008-65-4)

Guidance literature:

In toluene; at 85 ℃; for 16h;

DOI:10.1021/jo071223b

Reference yield:

4-chloronicotinic acid chloride hydrochloride → {(2S)-2-{bis[3,5-bis(trifluoromethyl)phenyl]hydroxymethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]methanone (951008-65-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 44 percent / Et₃N / CH₂Cl₂ / 0 - 20 °C

2: 95 percent / toluene / 16 h / 85 °C

With triethylamine; In dichloromethane; toluene;

DOI:10.1021/jo071223b

Reference yield:

(S)-(-)-α,α-bis[3,5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanol (848821-76-1) → {(2S)-2-{bis[3,5-bis(trifluoromethyl)phenyl]hydroxymethyl}-1-pyrrolidinyl}[4-(1-pyrrolidinyl)-3-pyridinyl]methanone (951008-65-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 44 percent / Et₃N / CH₂Cl₂ / 0 - 20 °C

2: 95 percent / toluene / 16 h / 85 °C

With triethylamine; In dichloromethane; toluene;

DOI:10.1021/jo071223b

upstream raw materials:

pyrrolidine

C₂₇H₁₇N₂O₂ClF₁₂

(S)-(-)-α,α-bis[3,5-bis(trifluoromethyl)phenyl]-2-pyrrolidinemethanol

4-chloronicotinic acid