2,2',3,3',4,5,6-Heptabromodiphenyl ether
TL;DR: 2,2',3,3',4,5,6-Heptabromodiphenyl ether (CAS 68928-80-3) is a chemical compound with molecular formula C12H3Br7O and molecular weight 715.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5-pentabromo-6-(2,3-dibromophenoxy)benzene
Also Known As: Heptabromodiphenyl ether, Heptabromodiphenyl oxide, Heptabromodiphenyl ethers, Diphenyl ether, heptabromo derivative, 1,2,3,4,5-pentabromo-6-(2,3-dibromophenoxy)benzene
| Molecular Formula | C12H3Br7O |
|---|---|
| Molecular Weight | 715.45 g/mol |
| LogP | 8.8164 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 715.4468 |
| Heavy Atoms | 20 |
| Complexity | 654.9866 |
Chemical Identifiers
| CAS Number | 68928-80-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br |
Product Overview
2,2',3,3',4,5,6-Heptabromodiphenyl ether (CAS 68928-80-3), with molecular formula C12H3Br7O and molecular weight 715.45 g/mol. IUPAC: 1,2,3,4,5-pentabromo-6-(2,3-dibromophenoxy)benzene.
Chemical Property Profile of 2,2',3,3',4,5,6-Heptabromodiphenyl ether
Property Insights of 2,2',3,3',4,5,6-Heptabromodiphenyl ether
The XLogP value of 8.8164 indicates that 2,2',3,3',4,5,6-Heptabromodiphenyl 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',4,5,6-Heptabromodiphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',3,3',4,5,6-Heptabromodiphenyl 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',4,5,6-Heptabromodiphenyl ether?
The CAS number of 2,2',3,3',4,5,6-Heptabromodiphenyl ether is 68928-80-3.
What is the molecular formula of 2,2',3,3',4,5,6-Heptabromodiphenyl ether?
The molecular formula of 2,2',3,3',4,5,6-Heptabromodiphenyl ether is C12H3Br7O.
What is the molecular weight of 2,2',3,3',4,5,6-Heptabromodiphenyl ether?
The molecular weight of 2,2',3,3',4,5,6-Heptabromodiphenyl ether is 715.45 g/mol.
Where can I buy 2,2',3,3',4,5,6-Heptabromodiphenyl ether?
You can request a quote for 2,2',3,3',4,5,6-Heptabromodiphenyl 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',4,5,6-Heptabromodiphenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 2,2',3,3',4,5,6-Heptabromodiphenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.