(Cyclohexylamino)morpholin-4-ylmethane-1-thione

Base Information

• Chemical Name: (Cyclohexylamino)morpholin-4-ylmethane-1-thione
• CAS No.: 36903-85-2
• Molecular Formula: C11H20N2OS
• Molecular Weight: 228.359
• DSSTox Substance ID: DTXSID701333607
• Nikkaji Number: J958.717I
• ChEMBL ID: CHEMBL1867699
• Mol file: 36903-85-2.mol

Synonyms:N-cyclohexylmorpholine-4-carbothioamide;N4-Cyclohexylmorpholine-4-carbothioamide;(cyclohexylamino)morpholin-4-ylmethane-1-thione;N-Cyclohexyl-4-morpholinecarbothioamide;36903-85-2;MLS000861132;CHEMBL1867699;SCHEMBL21903467;CCG-644;WFRSBKJYGRXBPG-UHFFFAOYSA-N;DTXSID701333607;HMS2802K14;AKOS003720102;4-Morpholinecarbothioamide, N-cyclohexyl-;N-Cyclohexyl-4-morpholinecarbothioamide #;SMR000459916;SR-01000643103-1

Chemical Property of (Cyclohexylamino)morpholin-4-ylmethane-1-thione

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 228.12963444
• Heavy Atom Count: 15
• Complexity: 211

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)NC(=S)N2CCOCC2

Technology Process of (Cyclohexylamino)morpholin-4-ylmethane-1-thione

There total 6 articles about (Cyclohexylamino)morpholin-4-ylmethane-1-thione 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: 91.0%

morpholine (110-91-8,99108-56-2) + cyclohexylamine (108-91-8,157973-60-9) + bis(1H-benzo[d][1,2,3]triazol-1-yl)methanethione (4314-19-6) → (cyclohexylamino)morpholin-4-ylmethane-1-thione (36903-85-2)

Guidance literature:

cyclohexylamine; bis(1H-benzo[d][1,2,3]triazol-1-yl)methanethione; In tetrahydrofuran; for 36h;

morpholine; With triethylamine; In tetrahydrofuran; for 36h;

DOI:10.1021/jo035680d

Reference yield: 88.0%

morpholine (110-91-8,99108-56-2) + chloroform (67-66-3,8013-54-5) + cyclohexylamine (108-91-8,157973-60-9) → (cyclohexylamino)morpholin-4-ylmethane-1-thione (36903-85-2)

Guidance literature:

chloroform; cyclohexylamine; With potassium tert-butylate; In 1,4-dioxane; tert-butyl alcohol; at 55 ℃; for 3h;

morpholine; With sulfur; potassium tert-butylate; In 1,4-dioxane; tert-butyl alcohol; at 55 ℃; for 8h;

DOI:10.1021/acs.orglett.7b00819

Reference yield: 56.0%

morpholine (110-91-8,99108-56-2) + isothiocyanatocyclohexane (1122-82-3) → (cyclohexylamino)morpholin-4-ylmethane-1-thione (36903-85-2)

Guidance literature:

With triethylamine; In dichloromethane; for 3h;

DOI:10.1016/S0968-0896(00)00193-0

upstream raw materials:

4,4'-(dithiodicarbonothioyl)dimorpholine

cyclohexylamine

morpholine

isothiocyanatocyclohexane

Downstream raw materials:

N-cyclohexyl-morpholine-4-carboximidic acid amide

C₂₀H₂₉N₃O₃S₃

N,N'-dicyclohexyl-4-morpholine carboxamidine