4-Morpholineethanamine, N-(6-(2-fluorophenyl)-4-methyl-3-pyridazinyl)-, dihydrochloride

Base Information

• Chemical Name: 4-Morpholineethanamine, N-(6-(2-fluorophenyl)-4-methyl-3-pyridazinyl)-, dihydrochloride
• CAS No.: 118269-89-9
• Molecular Formula: C₁₇H₂₁FN₄O*2ClH
• Molecular Weight: 389.3
• DSSTox Substance ID: DTXSID00152078
• Mol file: 118269-89-9.mol

Synonyms:4-Morpholineethanamine, N-(6-(2-fluorophenyl)-4-methyl-3-pyridazinyl)-, dihydrochloride;N-(6-(2-Fluorophenyl)-4-methyl-3-pyridazinyl)-4-morpholineethanamine dihydrochloride;118269-89-9;DTXSID00152078;LS-92867

Chemical Property of 4-Morpholineethanamine, N-(6-(2-fluorophenyl)-4-methyl-3-pyridazinyl)-, dihydrochloride

Chemical Property:

• Vapor Pressure: 4.44E-11mmHg at 25°C
• Boiling Point: 524.1°Cat760mmHg
• Flash Point: 270.8°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 388.1232949
• Heavy Atom Count: 25
• Complexity: 354

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=NN=C1NCCN2CCOCC2)C3=CC=CC=C3F.Cl.Cl

Technology Process of 4-Morpholineethanamine, N-(6-(2-fluorophenyl)-4-methyl-3-pyridazinyl)-, dihydrochloride

There total 4 articles about 4-Morpholineethanamine, N-(6-(2-fluorophenyl)-4-methyl-3-pyridazinyl)-, dihydrochloride 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:

2'-Fluoroacetophenone (445-27-2) → [6-(2-Fluoro-phenyl)-4-methyl-pyridazin-3-yl]-(2-morpholin-4-yl-ethyl)-amine; hydrochloride (118269-89-9)

Guidance literature:

Multi-step reaction with 4 steps

1: KOH / methanol; H₂O / 96 h / 4 °C

2: hydrazine hydrate / butan-1-ol / Heating

3: POCl₃ / 80 °C

With potassium hydroxide; hydrazine hydrate; trichlorophosphate; In methanol; water; butan-1-ol;

DOI:10.1021/jm00123a004

Reference yield:

4-(2-Fluoro-phenyl)-2-hydroxy-2-methyl-4-oxo-butyric acid → [6-(2-Fluoro-phenyl)-4-methyl-pyridazin-3-yl]-(2-morpholin-4-yl-ethyl)-amine; hydrochloride (118269-89-9)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrazine hydrate / butan-1-ol / Heating

2: POCl₃ / 80 °C

With hydrazine hydrate; trichlorophosphate; In butan-1-ol;

DOI:10.1021/jm00123a004

Reference yield:

6-(2-Fluoro-phenyl)-4-methyl-2H-pyridazin-3-one (118270-03-4) → [6-(2-Fluoro-phenyl)-4-methyl-pyridazin-3-yl]-(2-morpholin-4-yl-ethyl)-amine; hydrochloride (118269-89-9)

Guidance literature:

Multi-step reaction with 2 steps

1: POCl₃ / 80 °C

With trichlorophosphate;

DOI:10.1021/jm00123a004

upstream raw materials:

4-(2-AMINOETHYL)MORPHOLINE

3-Chloro-6-(2-fluoro-phenyl)-4-methyl-pyridazine

2'-Fluoroacetophenone

6-(2-Fluoro-phenyl)-4-methyl-2H-pyridazin-3-one