Tetrachloroguaiacol
TL;DR: Tetrachloroguaiacol (CAS 2539-17-5) is a chemical compound with molecular formula C7H4Cl4O2 and molecular weight 259.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5-tetrachloro-6-methoxyphenol
Also Known As: TETRACHLOROGUAIACOL, Methoxytetrachlorophenol, TETRACHLOROGUAJACOL, 2-Methoxytetrachlorophenol, 2,3,4,5-tetrachloro-6-methoxyphenol
| Molecular Formula | C7H4Cl4O2 |
|---|---|
| Molecular Weight | 259.90 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.8936 |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 2539-17-5 |
|---|---|
| SMILES | COC1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)O |
| InChIKey | YZZVKLJKDFFSFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tetrachloroguaiacol (CAS 2539-17-5), with molecular formula C7H4Cl4O2 and molecular weight 259.90 g/mol. IUPAC: 2,3,4,5-tetrachloro-6-methoxyphenol.
Chemical Property Profile of Tetrachloroguaiacol
Property Insights of Tetrachloroguaiacol
The XLogP value of 4.4 indicates that Tetrachloroguaiacol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Tetrachloroguaiacol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrachloroguaiacol has 1 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 Tetrachloroguaiacol?
The CAS number of Tetrachloroguaiacol is 2539-17-5.
What is the molecular formula of Tetrachloroguaiacol?
The molecular formula of Tetrachloroguaiacol is C7H4Cl4O2.
What is the molecular weight of Tetrachloroguaiacol?
The molecular weight of Tetrachloroguaiacol is 259.90 g/mol.
Where can I buy Tetrachloroguaiacol?
You can request a quote for Tetrachloroguaiacol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrachloroguaiacol?
Yes, KEHONG BIO provides custom synthesis services for Tetrachloroguaiacol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.