2,4,6-Trichloro-m-cresol
TL;DR: 2,4,6-Trichloro-m-cresol (CAS 551-76-8) is a chemical compound with molecular formula C7H5Cl3O and molecular weight 209.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trichloro-3-methylphenol
Also Known As: 2,4,6-Trichloro-m-cresol, 2,4,6-TRICHLORO-3-METHYLPHENOL, Phenol, 2,4,6-trichloro-3-methyl-, 2,4,6-Trichlor-m-kresol, 3-Methyl-2,4,6-trichlorophenol
| Molecular Formula | C7H5Cl3O |
|---|---|
| Molecular Weight | 209.94 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.9406 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 551-76-8 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1Cl)Cl)O)Cl |
| InChIKey | QTAATZDGGZYBDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Trichloro-m-cresol (CAS 551-76-8), with molecular formula C7H5Cl3O and molecular weight 209.94 g/mol. IUPAC: 2,4,6-trichloro-3-methylphenol.
Chemical Property Profile of 2,4,6-Trichloro-m-cresol
Property Insights of 2,4,6-Trichloro-m-cresol
The XLogP value of 3.8 indicates that 2,4,6-Trichloro-m-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, 2,4,6-Trichloro-m-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Trichloro-m-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 2,4,6-Trichloro-m-cresol?
The CAS number of 2,4,6-Trichloro-m-cresol is 551-76-8.
What is the molecular formula of 2,4,6-Trichloro-m-cresol?
The molecular formula of 2,4,6-Trichloro-m-cresol is C7H5Cl3O.
What is the molecular weight of 2,4,6-Trichloro-m-cresol?
The molecular weight of 2,4,6-Trichloro-m-cresol is 209.94 g/mol.
Where can I buy 2,4,6-Trichloro-m-cresol?
You can request a quote for 2,4,6-Trichloro-m-cresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trichloro-m-cresol?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trichloro-m-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.