1-(Diphenylmethyl)-3-methylazetidin-3-ol hydrochloride

Base Information

• Chemical Name: 1-(Diphenylmethyl)-3-methylazetidin-3-ol hydrochloride
• CAS No.: 133891-86-8
• Molecular Formula: C17H20ClNO
• Molecular Weight: 289.7998
• DSSTox Substance ID: DTXSID30559930
• Mol file: 133891-86-8.mol

Synonyms:133891-86-8;1-(diphenylmethyl)-3-methylazetidin-3-ol hydrochloride;1-(DIPHENYLMETHYL)-3-METHYL-3-AZETIDINOL HYDROCHLORIDE;1-BENZHYDRYL-3-METHYLAZETIDIN-3-OL HYDROCHLORIDE;1-benzhydryl-3-methylazetidin-3-ol;hydrochloride;1-Benzhydryl-3-methylazetidin-3-ol HCl;MFCD05664927;1-(Diphenylmethyl)-3-methylazetidin-3-ol HCl;SCHEMBL2951072;DTXSID30559930;ASMPVJOSECQRDB-UHFFFAOYSA-N;AB6122;AKOS022180837;SB22152;AS-44750;SY099689;CS-0052824;1-Benzhydryl-3-methyl-azetidin-3-ol hydrochloride;1-benzhydryl-3-methyl-azetidin-3-ol hydrochloride salt;1-BENZHYDRYL-3-METHYLAZETIDIN-3-OLHYDROCHLORIDE;1-diphenylmethyl-3-hydroxy-3-methylazetidine hydrochloride;1-(Diphenylmethyl)-3-methylazetidin-3-ol--hydrogen chloride (1/1)

Chemical Property of 1-(Diphenylmethyl)-3-methylazetidin-3-ol hydrochloride

Chemical Property:

• PSA: 23.47000
• LogP: 3.58250
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 289.1233420
• Heavy Atom Count: 20
• Complexity: 268

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-(Diphenylmethyl)-3-methylazetidin-3-olHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)O.Cl

Technology Process of 1-(Diphenylmethyl)-3-methylazetidin-3-ol hydrochloride

There total 3 articles about 1-(Diphenylmethyl)-3-methylazetidin-3-ol hydrochloride 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: 85.0%

2-chloromethyl-2-methyloxiran (598-09-4) + Benzhydrylamine (91-00-9) → 1-diphenylmethyl-3-hydroxy-3-methylazetidine hydrochloride (133891-86-8)

Guidance literature:

In methanol; 1.) r.t., 3 days, 2.) reflux, 3 days;

DOI:10.1021/jm00059a002

Reference yield: 75.0%

2-chloromethyl-2-methyloxiran (598-09-4) + 2-benzylaniline (28059-64-5) → 1-diphenylmethyl-3-hydroxy-3-methylazetidine hydrochloride (133891-86-8)

Guidance literature:

In methanol; at 20 ℃; for 92h; Heating / reflux;

Reference yield:

3-chloro-2,2-dimethyl-oxirane (6124-70-5) + Benzhydrylamine (91-00-9) → 1-diphenylmethyl-3-hydroxy-3-methylazetidine hydrochloride (133891-86-8)

Guidance literature:

In methanol;

upstream raw materials:

2-chloromethyl-2-methyloxiran

Benzhydrylamine

3-chloro-2,2-dimethyl-oxirane

2-benzylaniline

Refernces

• 1、 -. "Compositions for dyeing keratinic fibres, containing paraphenylenediamine derivatives with an azetidinyl group". . . Retrieved 2008/06/13.