(1H-Indazol-3-yl)-N,N-dimethylmethanamine

Base Information

• Chemical Name: (1H-Indazol-3-yl)-N,N-dimethylmethanamine
• CAS No.: 142910-86-9
• Molecular Formula: C₁₀H₁₃N₃
• Molecular Weight: 175.233
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID00597389
• Wikidata: Q72470672
• Mol file: 142910-86-9.mol

Synonyms:142910-86-9;(1H-Indazol-3-yl)-N,N-dimethylmethanamine;1-(1H-indazol-3-yl)-N,N-dimethylmethanamine;1-(2H-indazol-3-yl)-N,N-dimethylmethanamine;N,N-dimethyl-1H-Indazole-3-methanamine;[(1H-indazol-3-yl)methyl]dimethylamine;3-dimethylaminomethylazaindole;SCHEMBL1595677;DTXSID00597389;3-dimethylaminomethyl-1H-indazole;WOCYPIPPKIEYRA-UHFFFAOYSA-N;DB-019622;A885075

Chemical Property of (1H-Indazol-3-yl)-N,N-dimethylmethanamine

Chemical Property:

• Melting Point: 125~127
• Boiling Point: 302℃
• PKA: 14.00±0.40(Predicted)
• Flash Point: 137℃
• PSA: 31.92000
• Density: 1.155
• LogP: 1.62450
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 175.110947427
• Heavy Atom Count: 13
• Complexity: 170

Purity/Quality:

97% ^*data from raw suppliers

(1H-Indazol-3-yl)-N,N-dimethylmethanamine 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CC1=C2C=CC=CC2=NN1

Technology Process of (1H-Indazol-3-yl)-N,N-dimethylmethanamine

There total 4 articles about (1H-Indazol-3-yl)-N,N-dimethylmethanamine 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: 76.0%

1(2)H-indazole-3-carboxylic acid dimethylamide (99055-81-9) → 1-(1H-indazol-3-yl)-N,N-dimethylmethanamine (142910-86-9)

Guidance literature:

1⁽²⁾H-indazole-3-carboxylic acid dimethylamide; With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 0.5h;

With Glauber's salt; In tetrahydrofuran; for 1h;

Reference yield: 36.0%

dimethyl amine (124-40-3) + 1H-indazole-3-carboxaldehyde (5235-10-9) → 1-(1H-indazol-3-yl)-N,N-dimethylmethanamine (142910-86-9)

Guidance literature:

dimethyl amine; 1H-indazole-3-carboxaldehyde; In ethanol; acetonitrile; at 20 ℃; for 2h; Inert atmosphere;

With sodium tetrahydroborate; In ethanol; acetonitrile; at 20 ℃; for 24h; Inert atmosphere;

DOI:10.1002/cmdc.202000835

Reference yield:

methyl 1H-indazole-3-carboxylate (43120-28-1) → 1-(1H-indazol-3-yl)-N,N-dimethylmethanamine (142910-86-9)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂O

2: LiAlH₄; THF

With tetrahydrofuran; lithium aluminium tetrahydride; water;

DOI:10.1021/ja01128a042

upstream raw materials:

1⁽²⁾H-indazole-3-carboxylic acid dimethylamide

methyl 1H-indazole-3-carboxylate

dimethyl amine

1H-indazole-3-carboxaldehyde

Downstream raw materials:

endo-8-(1H-indazol-3-ylmethyl)-3-(4-chlorophenyl)-8-azabicyclo[3.2.1]octan-3-ol