2-TERT-BUTYL-4-NITROPHENOL

Base Information

• Chemical Name: 2-TERT-BUTYL-4-NITROPHENOL
• CAS No.: 6683-81-4
• Molecular Formula: C10H13NO3
• Molecular Weight: 195.218
• Hs Code.: 2908999090
• Mol file: 6683-81-4.mol

Synonyms:5-Nitro-2-hydroxy-1-tert.-butyl-benzol;4-Nitro-2-tert.-butyl-phenol;1-tert.-Butyl-2-hydroxy-5-nitro-benzol;2-t-butyl-4-nitrophenol;

Chemical Property of 2-TERT-BUTYL-4-NITROPHENOL

Chemical Property:

• Melting Point: 138.5-139.5 °C
• Boiling Point: 296.4±28.0 °C(Predicted)
• PKA: 8.56±0.22(Predicted)
• PSA: 66.05000
• Density: 1.173±0.06 g/cm3(Predicted)
• LogP: 3.12110
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)

Purity/Quality:

99% ^*data from raw suppliers

2-(tert-Butyl)-4-nitrophenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-TERT-BUTYL-4-NITROPHENOL

There total 7 articles about 2-TERT-BUTYL-4-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: 41.0%

2-tert-Butylphenol (88-18-6) → 2-tert-butyl-4-nitrophenol (6683-81-4) + 2-(tert-butyl)-6-nitrophenol (18515-04-3)

Guidance literature:

With nitric acid; In acetic acid; at 5 - 20 ℃; for 1.5h;

DOI:10.1002/ejic.201201549

Reference yield: 35.6%

2-tert-Butylphenol (88-18-6) → 2-tert-butyl-4-nitrophenol (6683-81-4)

Guidance literature:

With nitric acid; In n-heptane; water; for 2h;

Reference yield:

4-nitro-phenol (100-02-7,78813-13-5,89830-32-0) + isobutene (115-11-7,15220-85-6) → 2-tert-butyl-4-nitrophenol (6683-81-4)

Guidance literature:

With phosphoric acid; at 100 ℃;

DOI:10.1021/ja01277a060

upstream raw materials:

4-nitro-phenol

isobutene

1-bromo-2-tert-butyl-4-nitro-benzene

N-(2-tert-butyl-phenyl)-4-methyl-benzenesulfonamide

Downstream raw materials:

4-amino-2-t-butyl-6-(piperidin-1'-ylmethyl)phenol

2-bromo-6-tert-butyl-4-nitrophenol

1-tert-butyl-3-iodo-2-methoxy-5-nitrobenzene

N-(4-((3-(tert-butyl)-5-(2,4-dioxotetrahydropyrimidin-1(2H)-yl)-2-methoxyphenyl)ethynyl)phenyl)methanesulfonamide

Refernces

• 1、 Nizovtsev, Alexey V.,Scheurer, Andreas,Kosog, Boris,Heinemann, Frank W.,Meyer, Karsten. "Synthesis of differently substituted tacn-based ligands: Towards the control of solubility and electronic and steric properties of uranium coordination complexes". . p. 2538 - 2548. Retrieved 2013/07/11.
• 2、 -. "ANTI-INFECTIVE PYRIMIDINES AND USES THEREOF". Page/Page column 98; 104-105. . Retrieved 2009/04/25.