1,3-Dimethyl-1H-indazol-6-amine

Base Information

• Chemical Name: 1,3-Dimethyl-1H-indazol-6-amine
• CAS No.: 221681-92-1
• Molecular Formula: C9H11N3
• Molecular Weight: 161.20400
• Hs Code.: 2933990090
• European Community (EC) Number: 827-233-8
• DSSTox Substance ID: DTXSID80598314
• Wikidata: Q82494060
• Mol file: 221681-92-1.mol

Synonyms:221681-92-1;1,3-DIMETHYL-1H-INDAZOL-6-AMINE;1,3-DIMETHYL-6-AMINO-1H-INDAZOLE;1,3-dimethylindazol-6-amine;MFCD18432764;1H-Indazol-6-amine, 1,3-dimethyl-;1,3-Dimethylindazol-6-amine;SCHEMBL3340760;DTXSID80598314;WIA68192;AKOS022906093;PB19644;AS-34925;SY042235;DB-092842;CS-0052737;EN300-215294

Chemical Property of 1,3-Dimethyl-1H-indazol-6-amine

Chemical Property:

• Boiling Point: 335.4±22.0 °C(Predicted)
• PKA: 3.93±0.50(Predicted)
• PSA: 43.84000
• Density: 1.23±0.1 g/cm3(Predicted)
• LogP: 2.04510
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 161.095297364
• Heavy Atom Count: 12
• Complexity: 171

Purity/Quality:

98%,99%, ^*data from raw suppliers

1,3-dimethyl-1H-indazol-6-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NN(C2=C1C=CC(=C2)N)C
• Uses: 1,3-dimethyl-1H-indazol-6-amine is an impurity in the synthesis of Pazopanib (P210925) which is an oral angiogenesis inhibitor targeting VEGFR and PDGFR. It is used as a reagent in the preparation of glycinamide derivatives which are useful in production of drugs for preventing and treating diseases caused by S-adenosyl homocysteine hydrolase.

Technology Process of 1,3-Dimethyl-1H-indazol-6-amine

There total 1 articles about 1,3-Dimethyl-1H-indazol-6-amine 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:

3-methyl-6-nitro-1H-indazole (6494-19-5) + methyl iodide (74-88-4) → 1,3-dimethyl-1H-indazol-6-amine (221681-92-1) + 2,3-dimethyl-6-amino-2H-indazole (444731-72-0)

Guidance literature:

3-methyl-6-nitro-1H-indazole; methyl iodide; With potassium carbonate; In N,N-dimethyl-formamide; at 60 ℃; for 4h;

With palladium 10% on activated carbon; hydrogen; at 20 ℃; for 4h;

DOI:10.1039/d0ra09112j

upstream raw materials:

3-methyl-6-nitro-1H-indazole

methyl iodide

Refernces