Methyl phenethyl ether
TL;DR: Methyl phenethyl ether (CAS 3558-60-9) is a chemical compound with molecular formula C9H12O and molecular weight 136.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxyethylbenzene
Also Known As: (2-Methoxyethyl)benzene, Methyl phenethyl ether, 2-methoxyethylbenzene, Kewda ether, 2-Phenylethyl methyl ether
| Molecular Formula | C9H12O |
|---|---|
| Molecular Weight | 136.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 136.08882 |
| Heavy Atoms | 10 |
| Complexity | 74.0 |
| Boiling Point | 185.00 to 187.00 °C. @ 760.00 mm Hg |
| Density | 0.945-0.951 |
| Solubility | very slightly |
| Refractive Index | 1.497-1.501 |
Chemical Identifiers
| CAS Number | 3558-60-9 |
|---|---|
| SMILES | COCCC1=CC=CC=C1 |
| InChIKey | CQLYXIUHVFRXLT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl phenethyl ether (CAS 3558-60-9), with molecular formula C9H12O and molecular weight 136.09 g/mol. IUPAC: 2-methoxyethylbenzene.
Chemical Property Profile of Methyl phenethyl ether
Property Insights of Methyl phenethyl ether
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl phenethyl ether. With a topological polar surface area (TPSA) of 9.2 Ų, Methyl phenethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl phenethyl ether has 0 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 Methyl phenethyl ether?
The CAS number of Methyl phenethyl ether is 3558-60-9.
What is the molecular formula of Methyl phenethyl ether?
The molecular formula of Methyl phenethyl ether is C9H12O.
What is the molecular weight of Methyl phenethyl ether?
The molecular weight of Methyl phenethyl ether is 136.09 g/mol.
Where can I buy Methyl phenethyl ether?
You can request a quote for Methyl phenethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl phenethyl ether?
Yes, KEHONG BIO provides custom synthesis services for Methyl phenethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.