2-Benzoyl-4-benzylmorpholine

Base Information

• Chemical Name: 2-Benzoyl-4-benzylmorpholine
• CAS No.: 521969-46-0
• Molecular Formula: C18H19NO2
• Molecular Weight: 281.354
• DSSTox Substance ID: DTXSID401242164
• Nikkaji Number: J2.436.583B
• Mol file: 521969-46-0.mol

Synonyms:2-benzoyl-4-benzylmorpholine;SCHEMBL3881312;VUIUUPMMRIZOPM-UHFFFAOYSA-N;DTXSID401242164;521969-46-0;(4-Benzyl-morpholin-2-yl)-phenyl-methanone;Phenyl[4-(phenylmethyl)-2-morpholinyl]methanone;racemic (4-benzyl-morpholin-2-yl)-phenyl-methanone

Chemical Property of 2-Benzoyl-4-benzylmorpholine

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 281.141578849
• Heavy Atom Count: 21
• Complexity: 332

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1COC(CN1CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Technology Process of 2-Benzoyl-4-benzylmorpholine

There total 4 articles about 2-Benzoyl-4-benzylmorpholine 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: 79.0%

bromobenzene (108-86-1,52753-63-6) + 4-benzyl-2-cyanomorpholine (147767-51-9,126645-52-1) → (4-benzyl-morpholin-2-yl)-phenylmethanone (521969-46-0)

Guidance literature:

bromobenzene; With magnesium; In diethyl ether; at 20 ℃; Cooling with ice;

4-benzyl-2-cyanomorpholine; In diethyl ether; at 0 - 20 ℃;

With hydrogenchloride; water; In diethyl ether; at 0 ℃; for 0.0833333h;

DOI:10.1016/j.jfluchem.2011.02.018

Reference yield: 59.0%

phenylmagnesium chloride (100-59-4) + 4-benzyl-2-cyanomorpholine (147767-51-9,126645-52-1) → (4-benzyl-morpholin-2-yl)-phenylmethanone (521969-46-0)

Guidance literature:

phenylmagnesium chloride; 4-benzyl-2-cyanomorpholine; In tetrahydrofuran; toluene; at -3 - 7 ℃; for 5.5h;

With acetic acid; In tetrahydrofuran; water; toluene; at 0 - 20 ℃;

With sodium hydroxide; In water; toluene; at 0 - 11 ℃;

Reference yield:

(4-benzyl-morpholin-2-yl)-phenyl-methanone hydrochloride → (4-benzyl-morpholin-2-yl)-phenylmethanone (521969-46-0)

Guidance literature:

With sodium hydroxide; In dichloromethane; water;

upstream raw materials:

phenylmagnesium chloride

4-benzyl-2-cyanomorpholine

bromobenzene

N-Benzylethanolamine

Downstream raw materials:

E-trifluoro-methanesulfonic acid (4-benzyl-morpholin-2-ylidene)-phenyl-methyl ester

(S,R)-1-(4-benzyl-morpholin-2-yl)-2-(2-methoxy-phenyl)-1-phenyl-ethanol

4-benzyl-2-(2-phenyl-oxiranyl)-morpholine

(S,R)-1-(4-benzyl-morpholin-2-yl)-2-(5-fluoro-2-methoxy-phenyl)-1-phenyl-ethanol