Tetradecabromo-1,4-diphenoxybenzene
TL;DR: Tetradecabromo-1,4-diphenoxybenzene (CAS 58965-66-5) is a chemical compound with molecular formula C18Br14O2 and molecular weight 1352.85 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-[2,3,5,6-tetrabromo-4-(2,3,4,5,6-pentabromophenoxy)phenoxy]benzene
Also Known As: Tetradecabromo-1,4-diphenoxybenzene, Perbromo-1,4-diphenoxybenzene, SAYTEX 120, 4'-PEBPOBDE208, tetradecabromo-p-diphenoxybenzene
| Molecular Formula | C18Br14O2 |
|---|---|
| Molecular Weight | 1352.85 g/mol |
| LogP | 14.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 1366.8322 |
| Heavy Atoms | 34 |
| Complexity | 589.0 |
Chemical Identifiers
| CAS Number | 58965-66-5 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1Br)Br)OC2=C(C(=C(C(=C2Br)Br)Br)Br)Br)Br)Br)OC3=C(C(=C(C(=C3Br)Br)Br)Br)Br |
| InChIKey | YMIUHIAWWDYGGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetradecabromo-1,4-diphenoxybenzene (CAS 58965-66-5), with molecular formula C18Br14O2 and molecular weight 1352.85 g/mol. IUPAC: 1,2,3,4,5-pentabromo-6-[2,3,5,6-tetrabromo-4-(2,3,4,5,6-pentabromophenoxy)phenoxy]benzene.
Chemical Property Profile of Tetradecabromo-1,4-diphenoxybenzene
Property Insights of Tetradecabromo-1,4-diphenoxybenzene
The XLogP value of 14.7 indicates that Tetradecabromo-1,4-diphenoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Tetradecabromo-1,4-diphenoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetradecabromo-1,4-diphenoxybenzene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetradecabromo-1,4-diphenoxybenzene?
The CAS number of Tetradecabromo-1,4-diphenoxybenzene is 58965-66-5.
What is the molecular formula of Tetradecabromo-1,4-diphenoxybenzene?
The molecular formula of Tetradecabromo-1,4-diphenoxybenzene is C18Br14O2.
What is the molecular weight of Tetradecabromo-1,4-diphenoxybenzene?
The molecular weight of Tetradecabromo-1,4-diphenoxybenzene is 1352.85 g/mol.
Where can I buy Tetradecabromo-1,4-diphenoxybenzene?
You can request a quote for Tetradecabromo-1,4-diphenoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetradecabromo-1,4-diphenoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for Tetradecabromo-1,4-diphenoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.