3-Ethyl-5-methyl-2,4,6-trichlorophenol
TL;DR: 3-Ethyl-5-methyl-2,4,6-trichlorophenol (CAS 6658-11-3) is a chemical compound with molecular formula C9H9Cl3O and molecular weight 237.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trichloro-3-ethyl-5-methylphenol
Also Known As: 2,4,6-trichloro-3-ethyl-5-methylphenol, 2,4,6-Trichloro-3-Ethyl-5-Methyl-Phenol, n-pentylhydrazinehydrochloride, 3-ETHYL-5-METHYL-2,4,6-TRICHLOROPHENOL, Phenol,2,4,6-trichloro-3-ethyl-5-methyl-
| Molecular Formula | C9H9Cl3O |
|---|---|
| Molecular Weight | 237.97 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.9719 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 6658-11-3 |
|---|---|
| SMILES | CCC1=C(C(=C(C(=C1Cl)C)Cl)O)Cl |
| InChIKey | RXOQFAHAWHYIOQ-UHFFFAOYSA-N |
Product Overview
3-Ethyl-5-methyl-2,4,6-trichlorophenol (CAS 6658-11-3), with molecular formula C9H9Cl3O and molecular weight 237.97 g/mol. IUPAC: 2,4,6-trichloro-3-ethyl-5-methylphenol.
Chemical Property Profile of 3-Ethyl-5-methyl-2,4,6-trichlorophenol
Property Insights of 3-Ethyl-5-methyl-2,4,6-trichlorophenol
The XLogP value of 4.6 indicates that 3-Ethyl-5-methyl-2,4,6-trichlorophenol 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-Ethyl-5-methyl-2,4,6-trichlorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-5-methyl-2,4,6-trichlorophenol 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-Ethyl-5-methyl-2,4,6-trichlorophenol?
The CAS number of 3-Ethyl-5-methyl-2,4,6-trichlorophenol is 6658-11-3.
What is the molecular formula of 3-Ethyl-5-methyl-2,4,6-trichlorophenol?
The molecular formula of 3-Ethyl-5-methyl-2,4,6-trichlorophenol is C9H9Cl3O.
What is the molecular weight of 3-Ethyl-5-methyl-2,4,6-trichlorophenol?
The molecular weight of 3-Ethyl-5-methyl-2,4,6-trichlorophenol is 237.97 g/mol.
Where can I buy 3-Ethyl-5-methyl-2,4,6-trichlorophenol?
You can request a quote for 3-Ethyl-5-methyl-2,4,6-trichlorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-5-methyl-2,4,6-trichlorophenol?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-5-methyl-2,4,6-trichlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.