3,5-Ditert-butyl-2-nitrophenol

Base Information

Chemical Name:3,5-Ditert-butyl-2-nitrophenol
CAS No.:3114-67-8
Molecular Formula:C14H21NO3
Molecular Weight:251.326
Hs Code.:
DSSTox Substance ID:DTXSID00356554
Wikidata:Q82135954
Mol file:3114-67-8.mol

Synonyms:3,5-ditert-butyl-2-nitrophenol;3114-67-8;Oprea1_740964;AE-562/12222827;DTXSID00356554

Suppliers and Price of 3,5-Ditert-butyl-2-nitrophenol

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 5 raw suppliers

Chemical Property of 3,5-Ditert-butyl-2-nitrophenol

Chemical Property:

XLogP3:5.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:251.15214353
Heavy Atom Count:18
Complexity:309

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 3,5-Ditert-butyl-2-nitrophenol

There total 5 articles about 3,5-Ditert-butyl-2-nitrophenol 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: 45.0%

: 1138-52-9
3,5-Di-tert-butylphenol

: 3114-67-8
2-Nitro-3,5-di-tert-butyl-phenol

Guidance literature:: With sulfuric acid; nitric acid; In ethyl acetate; at 20 ℃; for 0.25h; Inert atmosphere;
DOI:10.1002/chem.201702378

Reference yield:

: 94037-81-7
3,5-di-tert-butyl-6-nitrocyclohexa-2,4-dienone

: 3114-67-8
2-Nitro-3,5-di-tert-butyl-phenol

Guidance literature:: In acetic anhydride; at -60 ℃;

Reference yield:

: 1460-02-2
1,3,5-Tri-tert-butylbenzene

: 3114-67-8
2-Nitro-3,5-di-tert-butyl-phenol

Guidance literature:: Multi-step reaction with 3 steps

1: (bromination)

2: CuO, Cu, aq. NaOH / 275 °C

3: aq. HNO₃, AcOH / Ambient temperature

With sodium hydroxide; nitric acid; copper; acetic acid; copper(II) oxide;
DOI:10.1139/v63-238