Cyclohexylamine, N-allyl-N-ethyl-1-phenyl-, hydrochloride

Base Information

• Chemical Name: Cyclohexylamine, N-allyl-N-ethyl-1-phenyl-, hydrochloride
• CAS No.: 91281-25-3
• Molecular Formula: C17H26ClN
• Molecular Weight: 279.848
• DSSTox Substance ID: DTXSID50238472
• Mol file: 91281-25-3.mol

Synonyms:N-Allyl-N-ethyl-1-phenylcyclohexylamine hydrochloride;Cyclohexylamine, N-allyl-N-ethyl-1-phenyl-, hydrochloride;91281-25-3;DTXSID50238472;LS-57600

Chemical Property of Cyclohexylamine, N-allyl-N-ethyl-1-phenyl-, hydrochloride

Chemical Property:

• Vapor Pressure: 9.8E-05mmHg at 25°C
• Boiling Point: 338.5°C at 760 mmHg
• Flash Point: 143.7°C
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 279.1753775
• Heavy Atom Count: 19
• Complexity: 246

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC=C)C1(CCCCC1)C2=CC=CC=C2.Cl

Technology Process of Cyclohexylamine, N-allyl-N-ethyl-1-phenyl-, hydrochloride

There total 4 articles about Cyclohexylamine, N-allyl-N-ethyl-1-phenyl-, hydrochloride 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: 55.0%

Cyclohexamine (2201-15-2) + allyl bromide (106-95-6) → N-allyl-N-ethyl-1-phenylcyclohexylamine hydrochloride (91281-25-3)

Guidance literature:

With potassium carbonate; In acetonitrile; for 6h; Heating;

DOI:10.1021/jm00376a006

Reference yield:

1-ethylamino-1-cyclohexanecarbonitrile (22912-24-9) → N-allyl-N-ethyl-1-phenylcyclohexylamine hydrochloride (91281-25-3)

Guidance literature:

Multi-step reaction with 2 steps

1: benzene / 0.5 h / Heating

2: 55 percent / K₂CO₃ / acetonitrile / 6 h / Heating

With potassium carbonate; In acetonitrile; benzene;

DOI:10.1021/jm00376a006

Reference yield:

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → N-allyl-N-ethyl-1-phenylcyclohexylamine hydrochloride (91281-25-3)

Guidance literature:

Multi-step reaction with 3 steps

1: concd. HCl / H₂O

2: benzene / 0.5 h / Heating

3: 55 percent / K₂CO₃ / acetonitrile / 6 h / Heating

With hydrogenchloride; potassium carbonate; In water; acetonitrile; benzene;

DOI:10.1021/jm00376a006

upstream raw materials:

Cyclohexamine

allyl bromide

1-ethylamino-1-cyclohexanecarbonitrile

cyclohexanone

Refernces