6-Tert-butoxy-2-tert-butyl-5-nitro-1H-indole

Base Information

Chemical Name:6-Tert-butoxy-2-tert-butyl-5-nitro-1H-indole
CAS No.:952664-74-3
Molecular Formula:C₁₆H₂₂N₂O₃
Molecular Weight:290.362
Hs Code.:
DSSTox Substance ID:DTXSID50697843
Wikidata:Q82627868
Mol file:952664-74-3.mol

Synonyms:6-TERT-BUTOXY-2-TERT-BUTYL-5-NITRO-1H-INDOLE;952664-74-3;2-tert-butyl-6-[(2-methylpropan-2-yl)oxy]-5-nitro-1H-indole;6-(tert-Butoxy)-2-(tert-butyl)-5-nitro-1H-indole;SCHEMBL1465664;DTXSID50697843;SVERKZLQFAYTSY-UHFFFAOYSA-N;A845258

Suppliers and Price of 6-Tert-butoxy-2-tert-butyl-5-nitro-1H-indole

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of 6-Tert-butoxy-2-tert-butyl-5-nitro-1H-indole

Chemical Property:

PSA：70.84000
LogP:5.07410
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:290.16304257
Heavy Atom Count:21
Complexity:392

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=CC2=CC(=C(C=C2N1)OC(C)(C)C)[N+](=O)[O-]

Technology Process of 6-Tert-butoxy-2-tert-butyl-5-nitro-1H-indole

There total 5 articles about 6-Tert-butoxy-2-tert-butyl-5-nitro-1H-indole 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: 21.0%

: 952664-71-0
N-(2-(3,3-dimethylbut-1-ynyl)-5-fluoro-4-nitrophenyl)butyramide

: 865-47-4
potassium tert-butylate

: 952664-74-3
6-tert-butoxy-2-tert-butyl-5-nitro-1H-indole

Guidance literature:: In N,N-dimethyl-formamide; at 70 ℃; for 2h;

Reference yield: 21.0%

: 952664-71-0
N-(2-(3,3-dimethylbut-1-ynyl)-5-fluoro-4-nitrophenyl)butyramide

: 952664-74-3
6-tert-butoxy-2-tert-butyl-5-nitro-1H-indole

Guidance literature:: With potassium tert-butylate; In N,N-dimethyl-formamide;

Reference yield:

: 2369-13-3
3-fluoro-4-nitroaniline

: 952664-74-3
6-tert-butoxy-2-tert-butyl-5-nitro-1H-indole

Guidance literature:: Multi-step reaction with 4 steps

1: bromine / chloroform; acetic acid

2: CuI; triethylamine / Pd(PPh₃)2Cl₂ / water; toluene

3: triethylamine / dichloromethane

4: potassium tert-butylate / N,N-dimethyl-formamide

With CuI; potassium tert-butylate; bromine; triethylamine; Pd(PPh₃)2Cl₂; In dichloromethane; chloroform; water; acetic acid; N,N-dimethyl-formamide; toluene;