1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane
TL;DR: 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane (CAS 56718-76-4) is a chemical compound with molecular formula C12H17ClO3 and molecular weight 244.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-3-[4-(2-methoxyethyl)phenoxy]propan-2-ol
Also Known As: Metoprolol related compound B, 1-Chloro-3-(4-(2-methoxyethyl)phenoxy)propan-2-ol, Metoprolol IMpurity 13, Metoprolol USP Rc B, rac 1-Chloro-3-[4-(2-methoxyethyl)phenoxy]-2-propanol
| Molecular Formula | C12H17ClO3 |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | 1.854 |
| Topological Polar Surface Area | 38.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 244.08662 |
| Heavy Atoms | 16 |
| Complexity | 286.82028 |
Chemical Identifiers
| CAS Number | 56718-76-4 |
|---|---|
| SMILES | COCCC1=CC=C(C=C1)OCC(CCl)O |
Product Overview
1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane (CAS 56718-76-4), with molecular formula C12H17ClO3 and molecular weight 244.09 g/mol. IUPAC: 1-chloro-3-[4-(2-methoxyethyl)phenoxy]propan-2-ol.
Chemical Property Profile of 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane
Property Insights of 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane
The XLogP value of 1.854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane. With a topological polar surface area (TPSA) of 38.69 Ų, 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane has 1 hydrogen bond donor(s) and 3 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 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane?
The CAS number of 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane is 56718-76-4.
What is the molecular formula of 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane?
The molecular formula of 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane is C12H17ClO3.
What is the molecular weight of 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane?
The molecular weight of 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane is 244.09 g/mol.
Where can I buy 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane?
You can request a quote for 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-2-hydroxy-3-(4-(2-methoxyethyl)phenoxy)-propane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.