2,2',3,3',5,5',6,6'-Octabromodiphenyl ether
TL;DR: 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether (CAS 67797-09-5) is a chemical compound with molecular formula C12H2Br8O and molecular weight 793.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4,5-tetrabromo-3-(2,3,5,6-tetrabromophenoxy)benzene
Also Known As: PBDE 202, 2,2',3,3',5,5',6,6'-octabromodiphenyl ether, BDE 202, Bis(2,3,5,6-tetrabromophenyl) ether, Benzene, 1,1'-oxybis(2,3,5,6-tetrabromo-
| Molecular Formula | C12H2Br8O |
|---|---|
| Molecular Weight | 793.36 g/mol |
| LogP | 9.5789 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 793.3573 |
| Heavy Atoms | 21 |
| Complexity | 614.173 |
Chemical Identifiers
| CAS Number | 67797-09-5 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Br)Br)OC2=C(C(=CC(=C2Br)Br)Br)Br)Br)Br |
Product Overview
2,2',3,3',5,5',6,6'-Octabromodiphenyl ether (CAS 67797-09-5), with molecular formula C12H2Br8O and molecular weight 793.36 g/mol. IUPAC: 1,2,4,5-tetrabromo-3-(2,3,5,6-tetrabromophenoxy)benzene.
Chemical Property Profile of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether
Property Insights of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether
The XLogP value of 9.5789 indicates that 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether?
The CAS number of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether is 67797-09-5.
What is the molecular formula of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether?
The molecular formula of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether is C12H2Br8O.
What is the molecular weight of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether?
The molecular weight of 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether is 793.36 g/mol.
Where can I buy 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether?
You can request a quote for 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 2,2',3,3',5,5',6,6'-Octabromodiphenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.