2-(2,4,6-Trichlorophenoxy)ethan-1-ol
TL;DR: 2-(2,4,6-Trichlorophenoxy)ethan-1-ol (CAS 6161-87-1) is a chemical compound with molecular formula C8H7Cl3O2 and molecular weight 239.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4,6-trichlorophenoxy)ethanol
Also Known As: 2-(2,4,6-Trichlorophenoxy)ethanol, 2-(2,4,6-trichlorophenoxy)ethan-1-ol, NCIOpen2_003446, 2-(246-Trichlorophenoxy)ethanol, Ethanol, 2-(2,4,6-trichlorophenoxy)-
| Molecular Formula | C8H7Cl3O2 |
|---|---|
| Molecular Weight | 239.95 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.95116 |
| Heavy Atoms | 13 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 6161-87-1 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)OCCO)Cl)Cl |
| InChIKey | LZTZSANFAWWCRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2,4,6-Trichlorophenoxy)ethan-1-ol (CAS 6161-87-1), with molecular formula C8H7Cl3O2 and molecular weight 239.95 g/mol. IUPAC: 2-(2,4,6-trichlorophenoxy)ethanol.
Chemical Property Profile of 2-(2,4,6-Trichlorophenoxy)ethan-1-ol
Property Insights of 2-(2,4,6-Trichlorophenoxy)ethan-1-ol
The XLogP value of 3.4 indicates that 2-(2,4,6-Trichlorophenoxy)ethan-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-(2,4,6-Trichlorophenoxy)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4,6-Trichlorophenoxy)ethan-1-ol 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 2-(2,4,6-Trichlorophenoxy)ethan-1-ol?
The CAS number of 2-(2,4,6-Trichlorophenoxy)ethan-1-ol is 6161-87-1.
What is the molecular formula of 2-(2,4,6-Trichlorophenoxy)ethan-1-ol?
The molecular formula of 2-(2,4,6-Trichlorophenoxy)ethan-1-ol is C8H7Cl3O2.
What is the molecular weight of 2-(2,4,6-Trichlorophenoxy)ethan-1-ol?
The molecular weight of 2-(2,4,6-Trichlorophenoxy)ethan-1-ol is 239.95 g/mol.
Where can I buy 2-(2,4,6-Trichlorophenoxy)ethan-1-ol?
You can request a quote for 2-(2,4,6-Trichlorophenoxy)ethan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4,6-Trichlorophenoxy)ethan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4,6-Trichlorophenoxy)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.