2-(2-Phenylethyl)pyrrolidine

Base Information

• Chemical Name: 2-(2-Phenylethyl)pyrrolidine
• CAS No.: 106366-30-7
• Molecular Formula: C12H17N
• Molecular Weight: 175.274
• Hs Code.: 2933990090
• European Community (EC) Number: 816-997-8
• DSSTox Substance ID: DTXSID40395528
• Mol file: 106366-30-7.mol

Synonyms:2-(2-phenylethyl)pyrrolidine;106366-30-7;2-phenethylpyrrolidine;2-Phenethyl-pyrrolidine;Pyrrolidine,2-(2-phenylethyl)-;2-phenethyl pyrrolidine;rac.-2-phenethylpyrrolidine;SCHEMBL2693506;DTXSID40395528;COZIXZLDDAZRGK-UHFFFAOYSA-N;rac-2-(2-phenylethyl)pyrrolidine;AR1055;MFCD01631840;AKOS000162647;AKOS016343552;3-Aminopyridine-2-carboxylic acidamide;PS-3579;2-(2-phenylethyl)pyrrolidine, AldrichCPR;BB 0249529;CS-0171325;EN300-50546;A911379;F8880-1682;Z281773822

Chemical Property of 2-(2-Phenylethyl)pyrrolidine

Chemical Property:

• Vapor Pressure: 0.00688mmHg at 25°C
• Refractive Index: 1.519
• Boiling Point: 270.3 °C at 760 mmHg
• PKA: 10.93±0.10(Predicted)
• Flash Point: 118.3 °C
• PSA: 12.03000
• Density: 0.957 g/cm³
• LogP: 2.70000
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 175.136099547
• Heavy Atom Count: 13
• Complexity: 138

Purity/Quality:

97% ^*data from raw suppliers

2-(2-Phenylethyl)pyrrolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C,Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(NC1)CCC2=CC=CC=C2

Technology Process of 2-(2-Phenylethyl)pyrrolidine

There total 16 articles about 2-(2-Phenylethyl)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: 90.1%

2-(1-phenylethyl)-3,4-dihydro-5H-pyrrole (106366-23-8) → (R,S)-2-phenethylpyrrolidine (106366-30-7)

Guidance literature:

With hydrogenchloride; sodium cyanoborohydride; In methanol; for 10h;

Reference yield: 82.0%

(±)-tert-butyl 2-phenethylpyrrolidine-1-carboxylate → (R,S)-2-phenethylpyrrolidine (106366-30-7)

Guidance literature:

With trifluoroacetic acid; at 0 ℃; for 0.5h;

Reference yield: 67.0%

tert-butyl (6-phenylhexyl)(tosyloxy)carbamate → (R,S)-2-phenethylpyrrolidine (106366-30-7)

Guidance literature:

With Rh₂(esp)2; trifluoroacetic acid; In 2,2,2-trifluoroethanol; at 20 ℃; for 21h; Inert atmosphere;

upstream raw materials:

2-(1-phenylethyl)-3,4-dihydro-5H-pyrrole

1-(2-[1,3]dioxolan-2-yl-ethyl)-3-phenyl-propylamine

C₂₅H₃₉N₃O₆

2-(3-azido-5-phenylpentyl)-1,3-dioxolane

Downstream raw materials:

C₁₃H₁₉N₃*ClH

C₁₃H₁₉N₃

2-methyl-5-{[2-(2-phenylethyl)-1-pyrrolidinyl]carbonyl} pyridine

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