Tetrabromocatechol
TL;DR: Tetrabromocatechol (CAS 488-47-1) is a chemical compound with molecular formula C6H2Br4O2 and molecular weight 421.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5,6-tetrabromobenzene-1,2-diol
Also Known As: TETRABROMOCATECHOL, Tetrabromopyrocatechol, Pyrocatechol, tetrabromo-, 3,4,5,6-tetrabromobenzene-1,2-diol, 3,4,5,6-Tetrabromocatechol
| Molecular Formula | C6H2Br4O2 |
|---|---|
| Molecular Weight | 421.68 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 425.67474 |
| Heavy Atoms | 12 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 488-47-1 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1Br)Br)Br)Br)O)O |
| InChIKey | OAUWOBSDSJNJQP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrabromocatechol (CAS 488-47-1), with molecular formula C6H2Br4O2 and molecular weight 421.68 g/mol. IUPAC: 3,4,5,6-tetrabromobenzene-1,2-diol.
Chemical Property Profile of Tetrabromocatechol
Property Insights of Tetrabromocatechol
The XLogP value of 4.0 indicates that Tetrabromocatechol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Tetrabromocatechol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrabromocatechol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetrabromocatechol?
The CAS number of Tetrabromocatechol is 488-47-1.
What is the molecular formula of Tetrabromocatechol?
The molecular formula of Tetrabromocatechol is C6H2Br4O2.
What is the molecular weight of Tetrabromocatechol?
The molecular weight of Tetrabromocatechol is 421.68 g/mol.
Where can I buy Tetrabromocatechol?
You can request a quote for Tetrabromocatechol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrabromocatechol?
Yes, KEHONG BIO provides custom synthesis services for Tetrabromocatechol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.