5-Acetyl-2-phenyl-3-propyl-1,3-oxazinane-4,6-dione

Base Information

• Chemical Name: 5-Acetyl-2-phenyl-3-propyl-1,3-oxazinane-4,6-dione
• CAS No.: 88091-14-9
• Molecular Formula: C₁₅H₁₇NO₄
• Molecular Weight: 275.304
• DSSTox Substance ID: DTXSID80524931

Synonyms:5-Acetyl-2-phenyl-3-propyl-1,3-oxazinane-4,6-dione;88091-14-9;DTXSID80524931

Chemical Property of 5-Acetyl-2-phenyl-3-propyl-1,3-oxazinane-4,6-dione

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 275.11575802
• Heavy Atom Count: 20
• Complexity: 401

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCN1C(OC(=O)C(C1=O)C(=O)C)C2=CC=CC=C2

Technology Process of 5-Acetyl-2-phenyl-3-propyl-1,3-oxazinane-4,6-dione

There total 2 articles about 5-Acetyl-2-phenyl-3-propyl-1,3-oxazinane-4,6-dione 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: 83.5%

N-benzylidenepropylamine (6852-55-7) + 5-acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione (72324-39-1) → 5-acetyl-3,4,5,6-tetrahydro-2-phenyl-3-propyl-1,3-oxazine-4,6-dione (88091-14-9)

Guidance literature:

In benzene; for 0.416667h; Heating;

Reference yield: 80.0%

N-benzylidenepropylamine (6852-55-7) + 5-acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione (72324-39-1) → 6-Methyl-2-phenyl-3-propyl-2,3-dihydro-[1,3]oxazin-4-one (81375-55-5) + 5-acetyl-3,4,5,6-tetrahydro-2-phenyl-3-propyl-1,3-oxazine-4,6-dione (88091-14-9)

Guidance literature:

In toluene; for 1h; Heating;

Reference yield: 55.0%

chloro-trimethyl-silane (75-77-4) + 5-acetyl-3,4,5,6-tetrahydro-2-phenyl-3-propyl-1,3-oxazine-4,6-dione (88091-14-9) → C18H25NO4Si (112632-11-8)

Guidance literature:

With triethylamine; In benzene; Ambient temperature;

upstream raw materials:

N-benzylidenepropylamine

5-acetyl-2,2-dimethyl-1,3-dioxane-4,6-dione

Downstream raw materials:

C₁₈H₂₅NO₄Si

trans-1-Propyl-3-acetyl-4-phenyl-2-azetidinone

6-Methyl-4-oxo-2-phenyl-3-propyl-3,4-dihydro-2H-[1,3]oxazine-5-carboxylic acid

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