Pbb 118
TL;DR: Pbb 118 (CAS 67888-97-5) 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.
1,2,4-tribromo-5-(3,4-dibromophenyl)benzene
Also Known As: 2,4,5,3',4'-Pentabromobiphenyl, 2,3',4,4',5-Pentabromobiphenyl, 2,3',4,4',5-Pentabromo-1,1'-biphenyl, 1,1'-Biphenyl, 2,3',4,4',5-pentabromo-, 2,3 ,4,4 ,5-Pentabromobiphenyl
| 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 | 547.6267 |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 67888-97-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2=CC(=C(C=C2Br)Br)Br)Br)Br |
| InChIKey | YOQVIFKWRYWBEP-UHFFFAOYSA-N |
Product Overview
Pbb 118 (CAS 67888-97-5), with molecular formula C12H5Br5 and molecular weight 543.63 g/mol. IUPAC: 1,2,4-tribromo-5-(3,4-dibromophenyl)benzene.
Chemical Property Profile of Pbb 118
Property Insights of Pbb 118
The XLogP value of 7.0 indicates that Pbb 118 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Pbb 118 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pbb 118 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 Pbb 118?
The CAS number of Pbb 118 is 67888-97-5.
What is the molecular formula of Pbb 118?
The molecular formula of Pbb 118 is C12H5Br5.
What is the molecular weight of Pbb 118?
The molecular weight of Pbb 118 is 543.63 g/mol.
Where can I buy Pbb 118?
You can request a quote for Pbb 118 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pbb 118?
Yes, KEHONG BIO provides custom synthesis services for Pbb 118 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.