2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol
TL;DR: 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol (CAS 111863-67-3) is a chemical compound with molecular formula C12H4Br6O2 and molecular weight 653.53 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrabromo-6-(2,4-dibromophenoxy)phenol
Also Known As: 6-OH-Bde 137, 2,3,4,5-tetrabromo-6-(2,4-dibromophenoxy)phenol, Phenol, 2,3,4,5-tetrabromo-6-(2,4-dibromophenoxy)-, 6-Hydroxy-2,2',3,4,4',5-hexabromodiphenylether, 3,4,5,6-Tetrabromo-2-(2',4'-dibromo-phenoxy)-phenol
| Molecular Formula | C12H4Br6O2 |
|---|---|
| Molecular Weight | 653.53 g/mol |
| LogP | 7.7595 |
| Topological Polar Surface Area | 29.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 653.5311 |
| Heavy Atoms | 20 |
| Complexity | 657.12823 |
Chemical Identifiers
| CAS Number | 111863-67-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)O |
Product Overview
2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol (CAS 111863-67-3), with molecular formula C12H4Br6O2 and molecular weight 653.53 g/mol. IUPAC: 2,3,4,5-tetrabromo-6-(2,4-dibromophenoxy)phenol.
Chemical Property Profile of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol
Property Insights of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol
The XLogP value of 7.7595 indicates that 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.46 Ų, 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol?
The CAS number of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol is 111863-67-3.
What is the molecular formula of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol?
The molecular formula of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol is C12H4Br6O2.
What is the molecular weight of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol?
The molecular weight of 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol is 653.53 g/mol.
Where can I buy 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol?
You can request a quote for 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5-Tetrabromo-6-(2,4-dibromophenoxy)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.