2,3,4,5,6-Pentabromobiphenyl
TL;DR: 2,3,4,5,6-Pentabromobiphenyl (CAS 56307-79-0) is a chemical compound with molecular formula C12H5Br5 and molecular weight 543.63 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-phenylbenzene
Also Known As: pentabromobiphenyl, 2,3,4,5,6-Pentabromobiphenyl, Pentabromo-1,1'-biphenyl, 2,3,4,5,6-Pentabromo-1,1'-biphenyl, 1,1'-Biphenyl, 2,3,4,5,6-pentabromo-
| Molecular Formula | C12H5Br5 |
|---|---|
| Molecular Weight | 543.63 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 543.6308 |
| Heavy Atoms | 17 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 56307-79-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=C(C(=C2Br)Br)Br)Br)Br |
| InChIKey | IUJGENMYAVALTR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4,5,6-Pentabromobiphenyl (CAS 56307-79-0), with molecular formula C12H5Br5 and molecular weight 543.63 g/mol. IUPAC: 1,2,3,4,5-pentabromo-6-phenylbenzene.
Chemical Property Profile of 2,3,4,5,6-Pentabromobiphenyl
Property Insights of 2,3,4,5,6-Pentabromobiphenyl
The XLogP value of 7.0 indicates that 2,3,4,5,6-Pentabromobiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3,4,5,6-Pentabromobiphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5,6-Pentabromobiphenyl has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,4,5,6-Pentabromobiphenyl?
The CAS number of 2,3,4,5,6-Pentabromobiphenyl is 56307-79-0.
What is the molecular formula of 2,3,4,5,6-Pentabromobiphenyl?
The molecular formula of 2,3,4,5,6-Pentabromobiphenyl is C12H5Br5.
What is the molecular weight of 2,3,4,5,6-Pentabromobiphenyl?
The molecular weight of 2,3,4,5,6-Pentabromobiphenyl is 543.63 g/mol.
Where can I buy 2,3,4,5,6-Pentabromobiphenyl?
You can request a quote for 2,3,4,5,6-Pentabromobiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5,6-Pentabromobiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5,6-Pentabromobiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.