(R)-2-(2-Chlorophenyl)pyrrolidine

Base Information

• Chemical Name: (R)-2-(2-Chlorophenyl)pyrrolidine
• CAS No.: 823188-58-5
• Molecular Formula: C10H12ClN
• Molecular Weight: 181.665
• DSSTox Substance ID: DTXSID20427992
• Wikidata: Q72457525
• Mol file: 823188-58-5.mol

Synonyms:(R)-2-(2-CHLOROPHENYL)PYRROLIDINE;823188-58-5;(2R)-2-(2-chlorophenyl)pyrrolidine;(R)-(+)-2-(2-chlorophenyl)-pyrrolidine;(2R)-2-(2-Chlorophenyl)pyrrolidine hcl;Pyrrolidine,2-(2-chlorophenyl)-, (2R)-;SCHEMBL5767533;DTXSID20427992;AFXDPDJNNABZGP-SNVBAGLBSA-N;AM9463;MFCD06762524;AKOS006295400;AKOS015933232;(R)-2-(2-chloro-phenyl)-pyrrolidine;AS-47917;CS-0197444;F16861

Chemical Property of (R)-2-(2-Chlorophenyl)pyrrolidine

Chemical Property:

• Vapor Pressure: 0.0176mmHg at 25°C
• Refractive Index: 1.548
• Boiling Point: 254.1 °C at 760 mmHg
• Flash Point: 107.5 °C
• PSA: 12.03000
• Density: 1.129 g/cm³
• LogP: 3.09330
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 181.0658271
• Heavy Atom Count: 12
• Complexity: 149

Purity/Quality:

99%, ^*data from raw suppliers

(R)-2-(2-Chlorophenyl)pyrrolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(NC1)C2=CC=CC=C2Cl
• Isomeric SMILES: C1C[C@@H](NC1)C2=CC=CC=C2Cl

Technology Process of (R)-2-(2-Chlorophenyl)pyrrolidine

There total 3 articles about (R)-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: 93.0%

pyrrolidine (123-75-1) + 2-(2-chlorophenyl)-pyrroline (858274-14-3) + phenylsilane (694-53-1) → (R)-2-(2-chlorophenyl)pyrrolidine (823188-58-5)

Guidance literature:

(R,R)-(+)-ethylene-1,2-bis(η5-4,5,6,7-tetrahydro-1-indenyl)titanium difluoride; In tetrahydrofuran; methanol; at 20 ℃; for 48h;

Reference yield: 71.1%

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

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:

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:

pyrrolidine

2-(2-chlorophenyl)-pyrroline

phenylsilane

2-(2-chlorophenyl)-1-pyrroline

Downstream raw materials:

C₂₅H₂₂ClF₃N₂O