Cas no 950-58-3 (4-Amino-2,6-DI-tert-butylphenol)

4-Amino-2,6-di-tert-butylphenol is a sterically hindered phenolic compound with notable antioxidant properties. Its molecular structure, featuring tert-butyl groups adjacent to the hydroxyl and amino functionalities, enhances stability and effectiveness in inhibiting oxidative degradation processes. This compound is commonly employed as an intermediate in organic synthesis and as an antioxidant in polymers, lubricants, and fuels, where it scavenges free radicals to prolong material lifespan. The amino group further expands its utility in derivatization reactions. Its high thermal stability and low volatility make it suitable for applications requiring prolonged exposure to elevated temperatures. The compound is typically handled under standard laboratory conditions, with precautions to avoid moisture and light degradation.
4-Amino-2,6-DI-tert-butylphenol structure
950-58-3 structure
Product Name:4-Amino-2,6-DI-tert-butylphenol
CAS No:950-58-3
MF:C14H23NO
MW:221.338524103165
MDL:MFCD01002935
CID:1001412
PubChem ID:314220
Update Time:2025-10-30

4-Amino-2,6-DI-tert-butylphenol Chemical and Physical Properties

Names and Identifiers

    • 4-Amino-2,6-di-tert-butylphenol
    • 4-amino-2,6-ditert-butylphenol
    • 2,6-di-t-butyl-4-aminophenol
    • 4-Amino-2,6-ditert-butyl-phenol
    • NSC231494
    • 2,6-di-t-butyl4-aminophenol
    • 4-amino-2,6-di-t-butylphenol
    • 4-amino 2,6-di-t-butylphenol
    • MNDTVJMRXYKBPV-UHFFFAOYSA-N
    • 2,6-di-tert-butyl-4-aminophenol
    • 2,6-di tert.butyl-4-aminophenol
    • 3,5-di-t-butyl-4-hydroxy-aniline
    • 2,6-di tert.butyl-4 -aminophenol
    • 4-amino-2,6-bis(tert-butyl)phenol
    • 6327AC
    • 3,5-di-tert-butyl-4-
    • AKOS016005736
    • A51137
    • AS-60492
    • CS-0186933
    • A851938
    • NSC-231494
    • DTXSID60310738
    • 4-amino-2,6-bis-(1,1-dimethylethyl)-phenol
    • 3,5-di-tert-butyl-4-hydroxyaniline
    • AM808191
    • EN300-25464954
    • SCHEMBL2802734
    • 950-58-3
    • MFCD01002935
    • 3,5 -di-tert-butyl-4-hydroxyaniline
    • DB-349065
    • 4-Amino-2,6-DI-tert-butylphenol
    • MDL: MFCD01002935
    • Inchi: 1S/C14H23NO/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8,16H,15H2,1-6H3
    • InChI Key: MNDTVJMRXYKBPV-UHFFFAOYSA-N
    • SMILES: OC1C(=CC(=CC=1C(C)(C)C)N)C(C)(C)C

Computed Properties

  • Exact Mass: 221.178
  • Monoisotopic Mass: 221.178
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 212
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 46.2
  • XLogP3: 4.2

Experimental Properties

  • Density: 0.99
  • Boiling Point: 309.3°C at 760 mmHg
  • Flash Point: 140.8°C
  • Refractive Index: 1.53

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4-Amino-2,6-DI-tert-butylphenol Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:950-58-3)4-Amino-2,6-DI-tert-butylphenol
Order Number:A851938
Stock Status:in Stock
Quantity:50mg/100mg/250mg/1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 07:38
Price ($):152.0/256.0/434.0/1172.0

Additional information on 4-Amino-2,6-DI-tert-butylphenol

Recent Advances in the Study of 4-Amino-2,6-DI-tert-butylphenol (CAS: 950-58-3) in Chemical Biology and Pharmaceutical Research

4-Amino-2,6-DI-tert-butylphenol (CAS: 950-58-3), a phenolic compound with significant antioxidant properties, has garnered increasing attention in the fields of chemical biology and pharmaceutical research. Recent studies have explored its potential applications in drug development, particularly as a protective agent against oxidative stress-related diseases. This research briefing synthesizes the latest findings on this compound, focusing on its molecular mechanisms, therapeutic potential, and recent advancements in synthesis and application.

Oxidative stress is implicated in numerous pathological conditions, including neurodegenerative diseases, cardiovascular disorders, and cancer. The antioxidant activity of 4-Amino-2,6-DI-tert-butylphenol has been extensively studied, with recent research highlighting its ability to scavenge free radicals and inhibit lipid peroxidation. A 2023 study published in the Journal of Medicinal Chemistry demonstrated that this compound exhibits superior radical scavenging activity compared to other phenolic antioxidants, making it a promising candidate for further drug development.

In addition to its antioxidant properties, recent investigations have revealed novel applications of 4-Amino-2,6-DI-tert-butylphenol in polymer stabilization and as a precursor for synthesizing more complex bioactive molecules. A breakthrough study in ACS Applied Materials & Interfaces (2024) reported its effectiveness in stabilizing polyethylene against thermal degradation, suggesting potential industrial applications alongside its pharmaceutical uses.

The molecular mechanisms underlying the biological activity of 4-Amino-2,6-DI-tert-butylphenol have been further elucidated through advanced computational and experimental approaches. Density functional theory (DFT) calculations have provided insights into its radical scavenging pathways, while in vitro studies have confirmed its low cytotoxicity at therapeutic concentrations. These findings, published in recent issues of Free Radical Biology and Medicine, support the compound's safety profile for potential clinical applications.

Current challenges in the field include optimizing the compound's bioavailability and developing targeted delivery systems. Recent patent filings (2023-2024) indicate growing commercial interest, with several pharmaceutical companies exploring formulations to enhance its therapeutic efficacy. The compound's unique chemical structure, characterized by the tert-butyl groups at positions 2 and 6 of the phenol ring, continues to inspire novel synthetic derivatives with improved pharmacological properties.

Future research directions are likely to focus on clinical translation of preclinical findings, particularly in neurodegenerative disease models where oxidative stress plays a key role. The compound's dual functionality as both an antioxidant and potential anti-inflammatory agent positions it as a versatile scaffold for multifunctional drug design. Collaborative efforts between academic researchers and pharmaceutical developers are expected to accelerate progress in this promising area of chemical biology.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:950-58-3)4-Amino-2,6-DI-tert-butylphenol
A851938
Purity:99%/99%/99%/99%
Quantity:50mg/100mg/250mg/1g
Price ($):152.0/256.0/434.0/1172.0
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