1-[1-(4-Methylpiperazin-1-YL)cyclohexyl]methanamine

Base Information

• Chemical Name: 1-[1-(4-Methylpiperazin-1-YL)cyclohexyl]methanamine
• CAS No.: 41805-59-8
• Molecular Formula: C12H25N3
• Molecular Weight: 211.351
• DSSTox Substance ID: DTXSID30426951
• Wikidata: Q82239729
• Mol file: 41805-59-8.mol

Synonyms:41805-59-8;(1-(4-methylpiperazin-1-yl)cyclohexyl)methanamine;1-[1-(4-METHYLPIPERAZIN-1-YL)CYCLOHEXYL]METHANAMINE;[1-(4-methylpiperazin-1-yl)cyclohexyl]methanamine;SCHEMBL16143384;DTXSID30426951;JVUTULSYUBFRCR-UHFFFAOYSA-N;BBL030340;STL371944;AKOS000197400;VS-09750;CS-0314799;FT-0742112;1-(1-aminomethylcyclohexyl)-4-methylpiperazine;1-[1-(Aminomethyl)cyclohexyl]-4-methyl piperazine;[1-(4-methyl-1-piperazinyl)cyclohexyl]methanamine, AldrichCPR

Chemical Property of 1-[1-(4-Methylpiperazin-1-YL)cyclohexyl]methanamine

Chemical Property:

• Vapor Pressure: 0.00947mmHg at 25°C
• Boiling Point: 264.9°C at 760 mmHg
• Flash Point: 112.7°C
• PSA: 32.50000
• Density: 0.997g/cm³
• LogP: 1.47150
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 211.204847810
• Heavy Atom Count: 15
• Complexity: 191

Purity/Quality:

99% ^*data from raw suppliers

(1-(4-methylpiperazin-1-yl)cyclohexyl)methanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCN(CC1)C2(CCCCC2)CN

Technology Process of 1-[1-(4-Methylpiperazin-1-YL)cyclohexyl]methanamine

There total 5 articles about 1-[1-(4-Methylpiperazin-1-YL)cyclohexyl]methanamine 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-cyano-cyclohexyl)-4-methyl-piperazine (22912-29-4) → 1-[1-(4-methylpiperazin-1-yl)cyclohexyl]methanamine (41805-59-8)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; Reflux;

DOI:10.1016/j.bmcl.2011.07.051

Reference yield:

1-methyl-piperazine (109-01-3) → 1-[1-(4-methylpiperazin-1-yl)cyclohexyl]methanamine (41805-59-8)

Guidance literature:

Multi-step reaction with 2 steps

1: zinc(II) iodide / methanol; diethyl ether / 8 h / 80 °C

2: lithium aluminium tetrahydride / diethyl ether / Reflux

With lithium aluminium tetrahydride; zinc(II) iodide; In methanol; diethyl ether; 1: Strecker reaction;

DOI:10.1016/j.bmcl.2011.07.051

Reference yield:

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 1-[1-(4-methylpiperazin-1-yl)cyclohexyl]methanamine (41805-59-8)

Guidance literature:

Multi-step reaction with 2 steps

1: zinc(II) iodide / methanol; diethyl ether / 8 h / 80 °C

2: lithium aluminium tetrahydride / diethyl ether / Reflux

With lithium aluminium tetrahydride; zinc(II) iodide; In methanol; diethyl ether; 1: Strecker reaction;

DOI:10.1016/j.bmcl.2011.07.051

upstream raw materials:

1-methyl-piperazine

cyclohexanone

1-(1-cyano-cyclohexyl)-4-methyl-piperazine

Downstream raw materials:

3,4-dichloro-N-[1-(4-methyl-piperazin-1-yl)-cyclohexylmethyl]-benzamide

N-[1-(4-methyl-piperazin-1-yl)-cyclohexylmethyl]-toluene-4-sulfonamide

N-[1-(4-methyl-piperazin-1-yl)-cyclohexylmethyl]-formamide

C₂₁H₃₃N₃O₂

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