alpha,alpha-Diphenyl-3-quinuclidineethanol

Base Information

Chemical Name:alpha,alpha-Diphenyl-3-quinuclidineethanol
CAS No.:57734-73-3
Molecular Formula:C21H25NO
Molecular Weight:307.4293
Hs Code.:
DSSTox Substance ID:DTXSID00973321
Nikkaji Number:J84.982K
ChEMBL ID:CHEMBL1187358

Synonyms:alpha,alpha-Diphenyl-3-quinuclidineethanol;BRN 1544868;57734-73-3;3-Quinuclidineethanol, alpha,alpha-diphenyl-;Benzhydrol, alpha-(3-quinuclidinylmethyl)-;Ethanol, 1,1-diphenyl-2-(3-quinuclidinyl)-;5-21-04-00177 (Beilstein Handbook Reference);CHEMBL1187358;SCHEMBL19884935;DTXSID00973321;LS-143109;2-(1-Azabicyclo[2.2.2]octan-3-yl)-1,1-diphenylethan-1-ol

Suppliers and Price of alpha,alpha-Diphenyl-3-quinuclidineethanol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of alpha,alpha-Diphenyl-3-quinuclidineethanol

Chemical Property:

Vapor Pressure:3.04E-09mmHg at 25°C
Boiling Point:459.6°Cat760mmHg
Flash Point:226.9°C
Density:1.15g/cm³
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:307.193614421
Heavy Atom Count:23
Complexity:357

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN2CCC1C(C2)CC(C3=CC=CC=C3)(C4=CC=CC=C4)O

Technology Process of alpha,alpha-Diphenyl-3-quinuclidineethanol

There total 4 articles about alpha,alpha-Diphenyl-3-quinuclidineethanol 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: 35.0%

: 57734-93-7
ethyl 1-azabicyclo<2.2.2>oct-3-ylacetate

: 100-58-3
phenylmagnesium bromide

: 57734-73-3
2-(1azabicyclo[2.2.2]oct-3-yl)-1,1-diphenylethanol

Guidance literature:: ethyl 1-azabicyclo<2.2.2>oct-3-ylacetate; phenylmagnesium bromide; In tetrahydrofuran; diethyl ether; at 0 - 55 ℃; Inert atmosphere;

With ammonium chloride; In tetrahydrofuran; diethyl ether; water; at 0 ℃;
DOI:10.1021/jm801601v

Reference yield:

: 3731-38-2
3-Quinuclidinone

: 57734-73-3
2-(1azabicyclo[2.2.2]oct-3-yl)-1,1-diphenylethanol

Guidance literature:: Multi-step reaction with 3 steps

1.1: sodium hydride / mineral oil; tetrahydrofuran / 0.5 h / 8 - 15 °C / Inert atmosphere

1.2: 20 - 55 °C

2.1: hydrogen; palladium 10% on activated carbon / ethanol / 20 °C / 760.05 Torr

3.1: tetrahydrofuran / 4.5 h / 4 - 55 °C / Inert atmosphere

With palladium 10% on activated carbon; hydrogen; sodium hydride; In tetrahydrofuran; ethanol; mineral oil;

Reference yield:

: 54238-09-4
3-(1-azabicyclo[2.2.2]oct-3-ylidene)-3-acetic acid ethyl ester

: 57734-73-3
2-(1azabicyclo[2.2.2]oct-3-yl)-1,1-diphenylethanol

Guidance literature:: Multi-step reaction with 2 steps

1: hydrogen; palladium 10% on activated carbon / ethanol / 20 °C / 760.05 Torr

2: tetrahydrofuran / 4.5 h / 4 - 55 °C / Inert atmosphere

With palladium 10% on activated carbon; hydrogen; In tetrahydrofuran; ethanol;