N-(6-Chloropyridazin-3-yl)acetamide

Base Information

• Chemical Name: N-(6-Chloropyridazin-3-yl)acetamide
• CAS No.: 14959-31-0
• Molecular Formula: C6H6ClN3O
• Molecular Weight: 171.586
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID30598026
• Nikkaji Number: J737.049K
• Wikidata: Q72458324
• Mol file: 14959-31-0.mol

Synonyms:N-(6-Chloropyridazin-3-yl)acetamide;14959-31-0;3-Acetamido-6-chloropyridazine;N-(6-Chloro-3-pyridazinyl)acetamide;N-(6-Chloro-pyridazin-3-yl)-acetamide;Acetamide, N-(6-chloro-3-pyridazinyl)-;MFCD09835313;SCHEMBL3152711;AMY1770;DTXSID30598026;UNQTYWWIVXWOJT-UHFFFAOYSA-N;AKOS006282937;N-(6--chloro-3-pyridazinyl)acetamide;SS-4877;SY283176;DB-030076;A3286;CS-0061074;F52718;J-523136

Chemical Property of N-(6-Chloropyridazin-3-yl)acetamide

Chemical Property:

• Appearance/Colour: Colorless transparent liquid
• Vapor Pressure: 1.04E-08mmHg at 25°C
• Melting Point: 250 °C (decomp)
• Refractive Index: 1.604
• Boiling Point: 461.8 °C at 760 mmHg
• PKA: 12.01±0.70(Predicted)
• Flash Point: 233.1 °C
• PSA: 54.88000
• Density: 1.419g/cm³
• LogP: 1.16140
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 171.0199395
• Heavy Atom Count: 11
• Complexity: 153

Purity/Quality:

97% ^*data from raw suppliers

3-Acetamido-6-chloropyridazine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=NN=C(C=C1)Cl

Technology Process of N-(6-Chloropyridazin-3-yl)acetamide

There total 4 articles about N-(6-Chloropyridazin-3-yl)acetamide 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: 95.0%

6-chloro-pyridazin-3-ylamine (5469-69-2) + acetic anhydride (108-24-7) → N-(6-chloropyridazin-3-yl)acetamide (14959-31-0)

Guidance literature:

With acetic acid; for 3h; Heating;

Reference yield: 83.5%

6-chloro-pyridazin-3-ylamine (5469-69-2) + acetic acid (64-19-7,77671-22-8) → N-(6-chloropyridazin-3-yl)acetamide (14959-31-0)

Guidance literature:

In acetonitrile; at 110 ℃; for 9h; Solvent; Temperature;

Reference yield:

N-Acetyl-N-(6-chloro-pyridazin-3-yl)-acetamide → N-(6-chloropyridazin-3-yl)acetamide (14959-31-0)

Guidance literature:

With 2,3,4-trimethoxybenzylalcohol; potassium tert-butylate; In 1,2-dimethoxyethane; at 85 ℃; for 2h; Yield given;

DOI:10.1016/0040-4039(96)00734-4

upstream raw materials:

6-chloro-pyridazin-3-ylamine

acetic anhydride

acetic acid

Downstream raw materials:

N-(6-(3-(dimethylamino)-1-phenylpropoxy)pyridazin-3-yl)acetamide

6-chloro-pyridazin-3-ylamine

3-amino-6-phenylthiopyridazine