Morpholine, 4-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-

Base Information

• Chemical Name: Morpholine, 4-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-
• CAS No.: 16963-28-3
• Molecular Formula: C14H25NO
• Molecular Weight: 223.359
• DSSTox Substance ID: DTXSID20463390
• Nikkaji Number: J381.377K
• Mol file: 16963-28-3.mol

Synonyms:SCHEMBL295938;DTXSID20463390;1-morpholino-4-t-butylcyclohexene;CFLBVNHHOOZJGH-UHFFFAOYSA-N;Morpholine, 4-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-;16963-28-3;4-(4-tert-butyl-cyclohex-1-enyl)-morpholine

Chemical Property of Morpholine, 4-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 223.193614421
• Heavy Atom Count: 16
• Complexity: 258

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)C1CCC(=CC1)N2CCOCC2

Technology Process of Morpholine, 4-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]-

There total 5 articles about Morpholine, 4-[4-(1,1-dimethylethyl)-1-cyclohexen-1-yl]- 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: 79.0%

morpholine (110-91-8,99108-56-2) + 1-methylcyclohexan-4-one (589-92-4) → 4-t-butyl-1-(morpholin-4-yl)cyclohex-1-ene (16963-28-3)

Guidance literature:

With toluene-4-sulfonic acid; In benzene; Heating;

DOI:10.1021/jo00168a009

Reference yield: 75.0%

morpholine (110-91-8,99108-56-2) + 4-tercbutyl-cyclohexanone (98-53-3) → 4-t-butyl-1-(morpholin-4-yl)cyclohex-1-ene (16963-28-3)

Guidance literature:

With toluene-4-sulfonic acid; In toluene; Heating;

Reference yield: 66.0%

morpholine (110-91-8,99108-56-2) + 1-trifluoromethanesulfonyloxy-4-t-butylcyclohexene (77412-96-5) → 4-t-butyl-1-(morpholin-4-yl)cyclohex-1-ene (16963-28-3)

Guidance literature:

With potassium carbonate; tert-butyl XPhos; tris(dibenzylideneacetone)dipalladium ⁽⁰⁾; In tert-butyl alcohol; at 80 ℃; for 20h;

DOI:10.1055/s-2005-918480

upstream raw materials:

morpholine

1-methylcyclohexan-4-one

4-tercbutyl-cyclohexanone

1-trifluoromethanesulfonyloxy-4-t-butylcyclohexene

Downstream raw materials:

cis-4-tert-butyl-2-(3-oxobutyl)cyclohexanone

8-tert-butylbicyclo<4.4.0>dec-1-en-3-one

(1α,4α,5α,7α)-7-tert-Butyl-4-ethoxy-2,4-diphenyl-3-azabicyclo<3.3.1>non-2-en-9-on

4-[4-tert-butyl-6-(2-nitro-1-phenyl-propyl)-cyclohex-1-enyl]-morpholine