Benzonitrile, 4,4'-[1,4-piperidinediylbis(3,1-propanediyloxy)]bis-

Base Information

• Chemical Name: Benzonitrile, 4,4'-[1,4-piperidinediylbis(3,1-propanediyloxy)]bis-
• CAS No.: 873546-80-6
• Molecular Formula: C25H29N3O2
• Molecular Weight: 403.524
• Mol file: 873546-80-6.mol

Synonyms:Benzonitrile, 4,4'-[1,4-piperidinediylbis(3,1-propanediyloxy)]bis-

Chemical Property of Benzonitrile, 4,4'-[1,4-piperidinediylbis(3,1-propanediyloxy)]bis-

Chemical Property:

• Boiling Point: 593.0±35.0 °C(Predicted)
• PKA: 9.57±0.10(Predicted)
• PSA: 69.28000
• Density: 1.15±0.1 g/cm3(Predicted)
• LogP: 4.70796

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of Benzonitrile, 4,4'-[1,4-piperidinediylbis(3,1-propanediyloxy)]bis-

There total 8 articles about Benzonitrile, 4,4'-[1,4-piperidinediylbis(3,1-propanediyloxy)]bis- 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:

4-[3-(4-piperidinyl)propoxy]benzonitrile (873546-79-3) + 4-(3-Bromopropoxy)benzonitrile (37136-86-0) → 4-(3-{4-[3-(4-cyanophenoxy)propyl]-1-piperidinyl}propoxy)benzonitrile (873546-80-6)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 18h;

Reference yield:

3-{1-[3-(4-cyanophenoxy)propyl]-4-piperidinyl}propyl methanesulfonate (943150-81-0) + 4-cyanophenol (767-00-0) → 4-(3-{4-[3-(4-cyanophenoxy)propyl]-1-piperidinyl}propoxy)benzonitrile (873546-80-6)

Guidance literature:

With potassium carbonate; In dimethyl sulfoxide; at 20 - 60 ℃; for 2h;

Reference yield:

tert-butyl 4-[3-(4-cyanophenoxy)propyl]-1-piperidinecarboxylate (873546-78-2) → 4-(3-{4-[3-(4-cyanophenoxy)propyl]-1-piperidinyl}propoxy)benzonitrile (873546-80-6)

Guidance literature:

Multi-step reaction with 2 steps

1: trifluoroacetic acid / chloroform; water / 1.08 h / 20 °C

2: potassium carbonate / N,N-dimethyl-formamide / 18 h / 20 °C

With potassium carbonate; trifluoroacetic acid; In chloroform; water; N,N-dimethyl-formamide;

upstream raw materials:

4-[3-(4-piperidinyl)propoxy]benzonitrile

4-(3-Bromopropoxy)benzonitrile

3-{1-[3-(4-cyanophenoxy)propyl]-4-piperidinyl}propyl methanesulfonate

4-cyanophenol

Downstream raw materials:

4-{3-[1-(3-{4-[amino(imino)methyl]phenoxy}propyl)piperidin-4-yl]propoxy}benzamidine

4-{3-[4-(3-{4-[amino(acetyloxyimino)methyl]phenoxy}propyl)-1-piperidinyl]propoxy}benzamide O-acetyloxime

4-{3-[4-(3-{4-[amino(isobutoxycarbonylimino)methyl]phenoxy}propyl)-1-piperidinyl]propoxy}-N'-(isobutoxycarbonyl)benzamidine

4-{3-[4-(3-{4-[amino(propoxycarbonylimino)methyl]phenoxy}propyl)-1-piperidinyl]propoxy}-N'-(propoxycarbonyl)benzamidine