(S)-2-(2-CHLOROPHENYL)PYRROLIDINE

Base Information

• Chemical Name: (S)-2-(2-CHLOROPHENYL)PYRROLIDINE
• CAS No.: 1217788-99-2
• Molecular Formula: C10H12ClN
• Molecular Weight: 181.66
• Mol file: 1217788-99-2.mol

Synonyms:(S)-2-(2-CHLOROPHENYL)PYRROLIDINE;(2S)-2-(2-CHLOROPHENYL)PYRROLIDINE

Chemical Property of (S)-2-(2-CHLOROPHENYL)PYRROLIDINE

Chemical Property:

• Boiling Point: 254.1±33.0 °C(Predicted)
• PKA: 9.45±0.10(Predicted)
• PSA: 12.03000
• Density: 1.129±0.06 g/cm3(Predicted)
• LogP: 3.09330
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of (S)-2-(2-CHLOROPHENYL)PYRROLIDINE

There total 3 articles about (S)-2-(2-CHLOROPHENYL)PYRROLIDINE 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: 72.0%

2-(2-chlorophenyl)-1-pyrroline (129540-25-6) → (S)-2-(2-chlorophenyl)pyrrolidine (1217788-99-2)

Guidance literature:

With hydrogenchloride; 2,3,4,5,6-pentahydroxy-hexanal; nicotinamide adenine dinucleotide phosphate; In aq. phosphate buffer; water; dimethyl sulfoxide; at 30 ℃; for 24h; pH=7; enantioselective reaction; Enzymatic reaction;

DOI:10.1021/acs.orglett.0c00802

Reference yield:

(S)-1-[2-(2-chlorophenyl)-1-pyrrolidinyl]-2,2,2-trifluoro-ethanone → (S)-2-(2-chlorophenyl)pyrrolidine (1217788-99-2)

Guidance literature:

With potassium hydroxide; In methanol; at 0 - 20 ℃; for 12.1667h; Sealed tube; Inert atmosphere;

DOI:10.1016/j.chempr.2020.02.002

Reference yield:

2-(2-chlorophenyl)-1-pyrroline (129540-25-6) → (R)-2-(2-chlorophenyl)pyrrolidine (823188-58-5) + (S)-2-(2-chlorophenyl)pyrrolidine (1217788-99-2)

Guidance literature:

With diethoxymethylane; diethylzinc; ((2S,2'S)-((2-hydroxy-5-methyl-1,3-phenylene)bis(methylene))bis(pyrrolidine-1,2-diyl))bis(diphenylmethanol); In tetrahydrofuran; toluene; at 4 ℃; for 48h; Overall yield = 72 percent; Overall yield = 62 mg; Inert atmosphere;

DOI:10.1002/adsc.202001043

upstream raw materials:

2-(2-chlorophenyl)-1-pyrroline

Downstream raw materials:

C₂₅H₂₂ClF₃N₂O

C₂₅H₂₁ClF₄N₂O

Refernces

• 1、 Binayeva, Meruyert,Biscoe, Mark R.,Diane, Mohamed,Ma, Xinghua,Ralph, Glenn,Wang, Chao-Yuan,Zhao, Haoran,Zhao, Shibin. "A General Approach to Stereospecific Cross-Coupling Reactions of Nitrogen-Containing Stereocenters". supporting information. p. 781 - 791. Retrieved 2020/03/11.