3-(((1,4-Benzodioxan-2-yl)methyl)methylamino)-N,N-dimethylpropionamide

Base Information

• Chemical Name: 3-(((1,4-Benzodioxan-2-yl)methyl)methylamino)-N,N-dimethylpropionamide
• CAS No.: 102128-81-4
• Molecular Formula: C₁₅H₂₂N₂O₃
• Molecular Weight: 278.351
• DSSTox Substance ID: DTXSID10907117
• Nikkaji Number: J87.410H

Synonyms:102128-81-4;1098 I.S.;BRN 0034984;3-(((1,4-Benzodioxan-2-yl)methyl)methylamino)-N,N-dimethylpropionamide;Propionamide, 3-(((1,4-benzodioxan-2-yl)methyl)methylamino)-N,N-dimethyl-;DTXSID10907117;1098 I.S;1098I.S.;LS-124042;N~3~-[(2,3-Dihydro-1,4-benzodioxin-2-yl)methyl]-N,N,N~3~-trimethyl-beta-alaninamide

Chemical Property of 3-(((1,4-Benzodioxan-2-yl)methyl)methylamino)-N,N-dimethylpropionamide

Chemical Property:

• Vapor Pressure: 1.33E-06mmHg at 25°C
• Boiling Point: 399.8°Cat760mmHg
• Flash Point: 195.6°C
• Density: 1.113g/cm³
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 278.16304257
• Heavy Atom Count: 20
• Complexity: 322

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C(=O)CCN(C)CC1COC2=CC=CC=C2O1

Technology Process of 3-(((1,4-Benzodioxan-2-yl)methyl)methylamino)-N,N-dimethylpropionamide

There total 2 articles about 3-(((1,4-Benzodioxan-2-yl)methyl)methylamino)-N,N-dimethylpropionamide 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:

2-chloromethyl-1,4-benzodioxane (2164-33-2) → N-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-N-methyl-β-alanine-dimethylamide (102128-81-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 180 °C

Reference yield:

2-(N-methylaminomethyl)-2,3-dihydro-1,4-benzodioxin (2242-31-1) + 3-chloro-N,N-dimethylpropionamide (17268-49-4) → N-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-N-methyl-β-alanine-dimethylamide (102128-81-4)

Guidance literature:

upstream raw materials:

2-(N-methylaminomethyl)-2,3-dihydro-1,4-benzodioxin

3-chloro-N,N-dimethylpropionamide

2-chloromethyl-1,4-benzodioxane

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