Pentabromobenzene
TL;DR: Pentabromobenzene (CAS 608-90-2) is a chemical compound with molecular formula C6HBr5 and molecular weight 467.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5-pentabromobenzene
Also Known As: PENTABROMOBENZENE, 1,2,3,4,5-pentabromobenzene, Benzene, pentabromo-, NONNEN SMC 65, C6HBr5
| Molecular Formula | C6HBr5 |
|---|---|
| Molecular Weight | 467.60 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 471.5954 |
| Heavy Atoms | 11 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 608-90-2 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Br)Br)Br)Br)Br |
| InChIKey | LLVVSBBXENOOQY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentabromobenzene (CAS 608-90-2), with molecular formula C6HBr5 and molecular weight 467.60 g/mol. IUPAC: 1,2,3,4,5-pentabromobenzene.
Chemical Property Profile of Pentabromobenzene
Property Insights of Pentabromobenzene
The XLogP value of 5.4 indicates that Pentabromobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Pentabromobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentabromobenzene 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 Pentabromobenzene?
The CAS number of Pentabromobenzene is 608-90-2.
What is the molecular formula of Pentabromobenzene?
The molecular formula of Pentabromobenzene is C6HBr5.
What is the molecular weight of Pentabromobenzene?
The molecular weight of Pentabromobenzene is 467.60 g/mol.
Where can I buy Pentabromobenzene?
You can request a quote for Pentabromobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentabromobenzene?
Yes, KEHONG BIO provides custom synthesis services for Pentabromobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.