2-(3-Chlorophenoxy)ethanol
TL;DR: 2-(3-Chlorophenoxy)ethanol (CAS 6161-83-7) is a chemical compound with molecular formula C8H9ClO2 and molecular weight 172.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenoxy)ethanol
Also Known As: 2-(3-Chlorophenoxy)ethanol, 2-(3-chlorophenoxy)ethan-1-ol, 2-(3-chloro-phenoxy)-ethanol, Ethanol,2-(3-chlorophenoxy)-, 228-191-8
| Molecular Formula | C8H9ClO2 |
|---|---|
| Molecular Weight | 172.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.02911 |
| Heavy Atoms | 11 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 6161-83-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)OCCO |
| InChIKey | GARMQVNIPCKVOJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3-Chlorophenoxy)ethanol (CAS 6161-83-7), with molecular formula C8H9ClO2 and molecular weight 172.03 g/mol. IUPAC: 2-(3-chlorophenoxy)ethanol.
Chemical Property Profile of 2-(3-Chlorophenoxy)ethanol
Property Insights of 2-(3-Chlorophenoxy)ethanol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Chlorophenoxy)ethanol. With a topological polar surface area (TPSA) of 29.5 Ų, 2-(3-Chlorophenoxy)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Chlorophenoxy)ethanol 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-(3-Chlorophenoxy)ethanol?
The CAS number of 2-(3-Chlorophenoxy)ethanol is 6161-83-7.
What is the molecular formula of 2-(3-Chlorophenoxy)ethanol?
The molecular formula of 2-(3-Chlorophenoxy)ethanol is C8H9ClO2.
What is the molecular weight of 2-(3-Chlorophenoxy)ethanol?
The molecular weight of 2-(3-Chlorophenoxy)ethanol is 172.03 g/mol.
Where can I buy 2-(3-Chlorophenoxy)ethanol?
You can request a quote for 2-(3-Chlorophenoxy)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chlorophenoxy)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chlorophenoxy)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.