1-Benzhydryl-3-methylazetidin-3-ol

Base Information

• Chemical Name: 1-Benzhydryl-3-methylazetidin-3-ol
• CAS No.: 40320-63-6
• Molecular Formula: C17H19 N O
• Molecular Weight: 253.344
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID10437267
• Wikidata: Q82252745
• Mol file: 40320-63-6.mol

Synonyms:1-benzhydryl-3-methylazetidin-3-ol;40320-63-6;1-(diphenylmethyl)-3-methylazetidin-3-ol;1-(DIPHENYLMETHYL)-3-METHYL-3-AZETIDINOL;1-benzhydryl-3-methyl-azetidin-3-ol;SCHEMBL71724;benzyl3-oxocyclobutylcarbamate;DTXSID10437267;BCVZHHLJPZIBCC-UHFFFAOYSA-N;MFCD05664928;SB50741;AS-41502;1-diphenylmethyl-3-hydroxy-3-methylazetidine;CS-0183571;FT-0741309

Chemical Property of 1-Benzhydryl-3-methylazetidin-3-ol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.62
• Boiling Point: 356.45°C at 760 mmHg
• Flash Point: 76.992°C
• PSA: 23.47000
• Density: 1.154g/cm³
• LogP: 2.78050
• Storage Temp.: 2-8°C
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 253.146664230
• Heavy Atom Count: 19
• Complexity: 268

Purity/Quality:

97% ^*data from raw suppliers

1-Benzhydryl-3-methylazetidin-3-ol 95+% ^*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

Technology Process of 1-Benzhydryl-3-methylazetidin-3-ol

There total 7 articles about 1-Benzhydryl-3-methylazetidin-3-ol 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: 100.0%

methyl magnesium iodide (917-64-6) + N-benzhydryl 3-azetidinone (40320-60-3) → 1-benzhydryl-3-methylazetidin-3-ol (40320-63-6)

Guidance literature:

In tetrahydrofuran; diethyl ether; at 0 ℃; for 1h;

Reference yield: 96.0%

N-benzhydryl 3-azetidinone (40320-60-3) + methylmagnesium chloride (676-58-4) → 1-benzhydryl-3-methylazetidin-3-ol (40320-63-6)

Guidance literature:

N-benzhydryl 3-azetidinone; methylmagnesium chloride; In tetrahydrofuran; at 0 - 20 ℃; for 1.83333h;

With water; ammonium chloride; In tetrahydrofuran; ethyl acetate;

Reference yield: 92.0%

N-benzhydryl 3-azetidinone (40320-60-3) + methylmagnesium bromide (75-16-1) → 1-benzhydryl-3-methylazetidin-3-ol (40320-63-6)

Guidance literature:

In tetrahydrofuran; at -78 - 20 ℃;

DOI:10.1021/acs.jmedchem.7b00621

upstream raw materials:

N-benzhydryl 3-azetidinone

methylmagnesium bromide

1-(diphenylmethyl)-3-hydroxyazetidine

Benzhydrylamine

Downstream raw materials:

methanesulfonic acid 1-benzhydryl-3-methylazetidin-3-yl ester

1-(diphenylmethyl)-3-(3-fluorophenoxy)-3-methylazetidine

3-hydroxy-3-methyl azetidine

(R)-6-(1-benzhydryl-3-methylazetidin-3-ylamino)-4-methyl-2,10-dihydro-9-oxa-1,2,4a-triazaphenanthren-3-one