3-Benzyl-8-propionyl-3,8-diazabicyclo[3.2.1]octane

Base Information

• Chemical Name: 3-Benzyl-8-propionyl-3,8-diazabicyclo[3.2.1]octane
• CAS No.: 63978-12-1
• Molecular Formula: C₁₆H₂₂N₂O
• Molecular Weight: 258.363
• Hs Code.: 2933990090
• Mol file: 63978-12-1.mol

Synonyms:3,8-Diazabicyclo[3.2.1]octane,3-benzyl-8-propionyl- (7CI); 3,8-Diazabicyclo[3.2.1]octane, 8-(1-oxopropyl)-3-(phenylmethyl)-(9CI)

Chemical Property of 3-Benzyl-8-propionyl-3,8-diazabicyclo[3.2.1]octane

Chemical Property:

• Vapor Pressure: 1.25E-06mmHg at 25°C
• Boiling Point: 400.7°C at 760 mmHg
• PKA: 8.53±0.20(Predicted)
• Flash Point: 170.5°C
• PSA: 23.55000
• Density: 1.117g/cm³
• LogP: 2.14760

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-Benzyl-8-propionyl-3,8-diazabicyclo[3.2.1]octane

There total 2 articles about 3-Benzyl-8-propionyl-3,8-diazabicyclo[3.2.1]octane 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:

propionyl chloride (79-03-8) + 3-benzyl-3,8-diazabicyclo[3.2.1]octane (67571-90-8) → 3-benzyl-8-propionyl-3,8-diaza-bicyclo[3.2.1]octane (63978-12-1)

Guidance literature:

With triethylamine; In toluene; for 2h; Heating;

DOI:10.1016/S0014-827X(98)00065-2

Reference yield:

→ 3-benzyl-8-propionyl-3,8-diaza-bicyclo[3.2.1]octane (63978-12-1)

Guidance literature:

3-Benzyl-3,8-diaza-bicyclo<3.2.1>octan, Propionsaeureanhydrid;

DOI:10.1021/jm00342a030

Reference yield:

3-benzyl-8-propionyl-3,8-diaza-bicyclo[3.2.1]octane (63978-12-1) → 3-[3-(2-nitro-phenyl)-allyl]-8-propionyl-3,8-diaza-bicyclo[3.2.1]octane (63990-47-6)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂ / 10 percent Pd/C / ethanol / Ambient temperature

2: 51 percent / K₂CO₃ / acetone / 6 h / Heating

With hydrogen; potassium carbonate; palladium on activated charcoal; In ethanol; acetone;

DOI:10.1016/S0014-827X(98)00065-2

upstream raw materials:

propionyl chloride

3-benzyl-3,8-diazabicyclo[3.2.1]octane

Downstream raw materials:

3-[3-(2-nitro-phenyl)-allyl]-8-propionyl-3,8-diaza-bicyclo[3.2.1]octane

3-[3-(3-nitro-phenyl)-allyl]-8-propionyl-3,8-diaza-bicyclo[3.2.1]octane