2,3-Dihydro-2,2-dimethyl-6-(4-phenoxyphenyl)-7-phenyl-1H-pyrrolizine

Base Information

• Chemical Name: 2,3-Dihydro-2,2-dimethyl-6-(4-phenoxyphenyl)-7-phenyl-1H-pyrrolizine
• CAS No.: 133111-57-6
• Molecular Formula: C₂₇H₂₅NO
• Molecular Weight: 379.502
• DSSTox Substance ID: DTXSID501159441
• Mol file: 133111-57-6.mol

Synonyms:SCHEMBL9463171;DTXSID501159441;2,3-Dihydro-2,2-dimethyl-6-(4-phenoxyphenyl)-7-phenyl-1H-pyrrolizine;133111-57-6

Chemical Property of 2,3-Dihydro-2,2-dimethyl-6-(4-phenoxyphenyl)-7-phenyl-1H-pyrrolizine

Chemical Property:

• XLogP3: 6.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 379.193614421
• Heavy Atom Count: 29
• Complexity: 525

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1(CC2=C(C(=CN2C1)C3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=CC=C5)C

Technology Process of 2,3-Dihydro-2,2-dimethyl-6-(4-phenoxyphenyl)-7-phenyl-1H-pyrrolizine

There total 1 articles about 2,3-Dihydro-2,2-dimethyl-6-(4-phenoxyphenyl)-7-phenyl-1H-pyrrolizine 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:

4-(phenoxy)phenacyl bromide (28179-33-1) + 5-benzyl-3,3-dimethyl-3,4-dihydro-2H-pyrrole (116673-95-1) → 2,2-Dimethyl-6-(4-phenoxy-phenyl)-7-phenyl-2,3-dihydro-1H-pyrrolizine (133111-57-6)

Guidance literature:

With sodium hydrogencarbonate; In diethyl ether; ethanol; water; for 36h; Ambient temperature;

DOI:10.1021/jm00038a021

Reference yield:

2,2-Dimethyl-6-(4-phenoxy-phenyl)-7-phenyl-2,3-dihydro-1H-pyrrolizine (133111-57-6) → [6,6-Dimethyl-2-(4-phenoxy-phenyl)-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]-acetic acid

Guidance literature:

Multi-step reaction with 2 steps

1: Cu / toluene / 0.25 h / Heating

2: 42 percent / 10percent aq. NaOH / ethanol / 0.17 h / Heating

With sodium hydroxide; copper; In ethanol; toluene;

DOI:10.1021/jm00038a021

Reference yield:

diazoacetic acid ethyl ester (623-73-4) + 2,2-Dimethyl-6-(4-phenoxy-phenyl)-7-phenyl-2,3-dihydro-1H-pyrrolizine (133111-57-6) → [6,6-Dimethyl-2-(4-phenoxy-phenyl)-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]-acetic acid ethyl ester (156897-32-4)

Guidance literature:

With copper; In toluene; for 0.25h; Heating;

DOI:10.1021/jm00038a021

upstream raw materials:

4-(phenoxy)phenacyl bromide

5-benzyl-3,3-dimethyl-3,4-dihydro-2H-pyrrole

Downstream raw materials:

[6,6-Dimethyl-2-(4-phenoxy-phenyl)-1-phenyl-6,7-dihydro-5H-pyrrolizin-3-yl]-acetic acid ethyl ester