(1E)-1-[1-(Chloromethyl)cyclohexyl]-N-phenylethan-1-imine

Base Information

• Chemical Name: (1E)-1-[1-(Chloromethyl)cyclohexyl]-N-phenylethan-1-imine
• CAS No.: 115437-06-4
• Molecular Formula: C15H20ClN
• Molecular Weight: 249.784
• DSSTox Substance ID: DTXSID40555721
• Mol file: 115437-06-4.mol

Synonyms:115437-06-4;DTXSID40555721;(1E)-1-[1-(Chloromethyl)cyclohexyl]-N-phenylethan-1-imine

Chemical Property of (1E)-1-[1-(Chloromethyl)cyclohexyl]-N-phenylethan-1-imine

Chemical Property:

• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 249.1284273
• Heavy Atom Count: 17
• Complexity: 260

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=NC1=CC=CC=C1)C2(CCCCC2)CCl

Technology Process of (1E)-1-[1-(Chloromethyl)cyclohexyl]-N-phenylethan-1-imine

There total 1 articles about (1E)-1-[1-(Chloromethyl)cyclohexyl]-N-phenylethan-1-imine 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:

1-(1-Chloromethyl-cyclohexyl)-ethanone (115437-03-1) + aniline (62-53-3) → [1-(1-Chloromethyl-cyclohexyl)-eth-(E)-ylidene]-phenyl-amine (115437-06-4)

Guidance literature:

With titanium tetrachloride; for 24h; Ambient temperature;

DOI:10.1016/S0040-4020(01)85996-2

Reference yield: 90.0%

[1-(1-Chloromethyl-cyclohexyl)-eth-(E)-ylidene]-phenyl-amine (115437-06-4) → 1-Methyl-2-phenyl-2-aza-spiro[3.5]nonane (119220-01-8)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 360h; Heating;

DOI:10.1016/S0040-4020(01)85996-2

Reference yield: 87.0%

[1-(1-Chloromethyl-cyclohexyl)-eth-(E)-ylidene]-phenyl-amine (115437-06-4) → 1-Methylene-2-phenyl-2-aza-spiro[3.5]nonane (115437-11-1)

Guidance literature:

With potassium tert-butylate; In tert-butyl alcohol; for 72h; Heating;

DOI:10.1021/jo00254a008

upstream raw materials:

1-(1-Chloromethyl-cyclohexyl)-ethanone

aniline

Downstream raw materials:

1-Methyl-2-phenyl-2-aza-spiro[3.5]nonane

1-Methylene-2-phenyl-2-aza-spiro[3.5]nonane