2,2',3,3',4,4',5,5',6-九溴二苯醚
TL;DR: 2,2',3,3',4,4',5,5',6-九溴二苯醚 (CAS 63387-28-0) is a chemical compound with molecular formula C12HBr9O and molecular weight 871.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2',3,3',4,4',5,5',6-九溴二苯醚
1,2,3,4,5-pentabromo-6-(2,3,4,5-tetrabromophenoxy)benzene
Also Known As: Nonabromodiphenyl ether, Nonabromophenoxybenzene, pentabromo benzene, Nonabromodiphenyl oxide, NONABROMODIPHENYLETHER
| Molecular Formula | C12HBr9O |
|---|---|
| Molecular Weight | 871.27 g/mol |
| LogP | 9.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 879.2596 |
| Heavy Atoms | 22 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 63387-28-0 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Br)Br)Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br |
| InChIKey | CYRHBNRLQMLULE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2',3,3',4,4',5,5',6-九溴二苯醚 (CAS 63387-28-0), with molecular formula C12HBr9O and molecular weight 871.27 g/mol. IUPAC: 1,2,3,4,5-pentabromo-6-(2,3,4,5-tetrabromophenoxy)benzene.
Chemical Property Profile of 2,2',3,3',4,4',5,5',6-九溴二苯醚
Property Insights of 2,2',3,3',4,4',5,5',6-九溴二苯醚
The XLogP value of 9.7 indicates that 2,2',3,3',4,4',5,5',6-九溴二苯醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 2,2',3,3',4,4',5,5',6-九溴二苯醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',3,3',4,4',5,5',6-九溴二苯醚 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',4,4',5,5',6-九溴二苯醚?
The CAS number of 2,2',3,3',4,4',5,5',6-九溴二苯醚 is 63387-28-0.
What is the molecular formula of 2,2',3,3',4,4',5,5',6-九溴二苯醚?
The molecular formula of 2,2',3,3',4,4',5,5',6-九溴二苯醚 is C12HBr9O.
What is the molecular weight of 2,2',3,3',4,4',5,5',6-九溴二苯醚?
The molecular weight of 2,2',3,3',4,4',5,5',6-九溴二苯醚 is 871.27 g/mol.
Where can I buy 2,2',3,3',4,4',5,5',6-九溴二苯醚?
You can request a quote for 2,2',3,3',4,4',5,5',6-九溴二苯醚 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',4,4',5,5',6-九溴二苯醚?
Yes, KEHONG BIO provides custom synthesis services for 2,2',3,3',4,4',5,5',6-九溴二苯醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.