2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol
TL;DR: 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol (CAS 309286-48-4) is a chemical compound with molecular formula C21H24BrNO3 and molecular weight 417.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-2-hydroxyphenyl)-4,6-ditert-butyl-1,3-benzoxazol-7-ol
Also Known As: BAS 01029771, 2-(5-bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol, 2-(5-bromo-2-hydroxyphenyl)-4,6-ditert-butyl-1,3-benzoxazol-7-ol, 2-(5-bromo-2-hydroxyphenyl)-4,6-di-tert-butylbenzo[d]oxazol-7-ol, A2136/0089653
| Molecular Formula | C21H24BrNO3 |
|---|---|
| Molecular Weight | 417.09 g/mol |
| LogP | 6.2635 |
| Topological Polar Surface Area | 66.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 417.09396 |
| Heavy Atoms | 26 |
| Complexity | 991.1296 |
Chemical Identifiers
| CAS Number | 309286-48-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C2=C1N=C(O2)C3=C(C=CC(=C3)Br)O)O)C(C)(C)C |
Product Overview
2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol (CAS 309286-48-4), with molecular formula C21H24BrNO3 and molecular weight 417.09 g/mol. IUPAC: 2-(5-bromo-2-hydroxyphenyl)-4,6-ditert-butyl-1,3-benzoxazol-7-ol.
Chemical Property Profile of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol
Property Insights of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol
The XLogP value of 6.2635 indicates that 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol. Following Lipinski's Rule of Five, 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol?
The CAS number of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol is 309286-48-4.
What is the molecular formula of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol?
The molecular formula of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol is C21H24BrNO3.
What is the molecular weight of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol?
The molecular weight of 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol is 417.09 g/mol.
Where can I buy 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol?
You can request a quote for 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Bromo-2-hydroxyphenyl)-4,6-di-tert-butyl-1,3-benzoxazol-7-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.