3,4,5,6-Tetrabromo-o-cresol
TL;DR: 3,4,5,6-Tetrabromo-o-cresol (CAS 576-55-6) is a chemical compound with molecular formula C7H4Br4O and molecular weight 419.70 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrabromo-6-methylphenol
Also Known As: 3,4,5,6-Tetrabromo-o-cresol, 2,3,4,5-Tetrabromo-6-methylphenol, Satinasept, Desderman, Remanol
| Molecular Formula | C7H4Br4O |
|---|---|
| Molecular Weight | 419.70 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 423.69547 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 576-55-6 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1Br)Br)Br)Br)O |
| InChIKey | GGIDUULRWQOXLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5,6-Tetrabromo-o-cresol (CAS 576-55-6), with molecular formula C7H4Br4O and molecular weight 419.70 g/mol. IUPAC: 2,3,4,5-tetrabromo-6-methylphenol.
Chemical Property Profile of 3,4,5,6-Tetrabromo-o-cresol
Property Insights of 3,4,5,6-Tetrabromo-o-cresol
The XLogP value of 4.7 indicates that 3,4,5,6-Tetrabromo-o-cresol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 3,4,5,6-Tetrabromo-o-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5,6-Tetrabromo-o-cresol has 1 hydrogen bond donor(s) and 1 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 3,4,5,6-Tetrabromo-o-cresol?
The CAS number of 3,4,5,6-Tetrabromo-o-cresol is 576-55-6.
What is the molecular formula of 3,4,5,6-Tetrabromo-o-cresol?
The molecular formula of 3,4,5,6-Tetrabromo-o-cresol is C7H4Br4O.
What is the molecular weight of 3,4,5,6-Tetrabromo-o-cresol?
The molecular weight of 3,4,5,6-Tetrabromo-o-cresol is 419.70 g/mol.
Where can I buy 3,4,5,6-Tetrabromo-o-cresol?
You can request a quote for 3,4,5,6-Tetrabromo-o-cresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5,6-Tetrabromo-o-cresol?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5,6-Tetrabromo-o-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.