2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol
TL;DR: 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol (CAS 84755-44-2) is a chemical compound with molecular formula C20H25N3O2 and molecular weight 339.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-ditert-butyl-6-(1-oxidobenzotriazol-1-ium-2-yl)phenol
Also Known As: 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol, 2-(2-hydroxy-3,5-di-t-butylphenyl)benzotriazole-N-oxide, 2,4-ditert-butyl-6-(1-oxidobenzotriazol-1-ium-2-yl)phenol, 2-(2'-hydroxy-3',5'-di-t-butylphenyl)benzotriazole-N-oxide, 2-(3,5-Di-tert-butyl-2-hydroxyphenyl)-2H-benzotriazole 1-oxide
| Molecular Formula | C20H25N3O2 |
|---|---|
| Molecular Weight | 339.19 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 63.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.19467 |
| Heavy Atoms | 25 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 84755-44-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)N2N=C3C=CC=CC3=[N+]2[O-])O)C(C)(C)C |
| InChIKey | LIPRFPHMPPZDQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol (CAS 84755-44-2), with molecular formula C20H25N3O2 and molecular weight 339.19 g/mol. IUPAC: 2,4-ditert-butyl-6-(1-oxidobenzotriazol-1-ium-2-yl)phenol.
Chemical Property Profile of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol
Property Insights of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol
The XLogP value of 6.6 indicates that 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol. Following Lipinski's Rule of Five, 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol?
The CAS number of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol is 84755-44-2.
What is the molecular formula of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol?
The molecular formula of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol is C20H25N3O2.
What is the molecular weight of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol?
The molecular weight of 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol is 339.19 g/mol.
Where can I buy 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol?
You can request a quote for 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Di-tert-butyl-6-(1-oxo-2H-1lambda~5~,2,3-benzotriazol-2-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.