2,3,4,5,6-Pentabromostyrene
TL;DR: 2,3,4,5,6-Pentabromostyrene (CAS 53097-59-9) is a chemical compound with molecular formula C8H3Br5 and molecular weight 493.61517 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4,5-pentabromo-6-ethenylbenzene
Also Known As: 2,3,4,5,6-Pentabromostyrene, Ar-Pentabromostyrene, Benzene, pentabromoethenyl-, vinyl pentabromobenzene, 1,2,3,4,5-pentabromo-6-ethenylbenzene
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H3Br5 |
| Molecular Weight | 493.61517 g/mol |
| XLogP | 6.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 497.61105 Da |
| Heavy Atoms | 13 |
| Complexity | 179.0 |
| SMILES | C=CC1=C(C(=C(C(=C1Br)Br)Br)Br)Br |
| InChIKey | BMSUWQXMTMGEOM-UHFFFAOYSA-N |
Chemical Property Profile of 2,3,4,5,6-Pentabromostyrene
Property Insights of 2,3,4,5,6-Pentabromostyrene
The XLogP value of 6.2 indicates that 2,3,4,5,6-Pentabromostyrene 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-Pentabromostyrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5,6-Pentabromostyrene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2,3,4,5,6-Pentabromostyrene?
The CAS number of 2,3,4,5,6-Pentabromostyrene is 53097-59-9.
What is the molecular formula of 2,3,4,5,6-Pentabromostyrene?
The molecular formula of 2,3,4,5,6-Pentabromostyrene is C8H3Br5.
What is the molecular weight of 2,3,4,5,6-Pentabromostyrene?
The molecular weight of 2,3,4,5,6-Pentabromostyrene is 493.61517 g/mol.
Where can I buy 2,3,4,5,6-Pentabromostyrene?
You can request a quote for 2,3,4,5,6-Pentabromostyrene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3,4,5,6-Pentabromostyrene?
Yes, CoreyChem provides custom synthesis services for 2,3,4,5,6-Pentabromostyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.