2-Methylanisole
TL;DR: 2-Methylanisole (CAS 578-58-5) is a chemical compound with molecular formula C8H10O and molecular weight 122.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-2-methylbenzene
Also Known As: 2-Methylanisole, 1-Methoxy-2-methylbenzene, o-Methylanisole, 2-Methoxytoluene, o-Methoxytoluene
| Molecular Formula | C8H10O |
|---|---|
| Molecular Weight | 122.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 122.073166 |
| Heavy Atoms | 9 |
| Complexity | 80.0 |
| Melting Point | -34.1 °C |
| Boiling Point | 170.00 to 172.00 °C. @ 760.00 mm Hg |
| Density | 0.983-0.986 (15.5°) |
| Solubility | Insoluble in water, soluble in oils |
| Vapor Pressure | 1.5 [mmHg] |
| Refractive Index | 1.518-1.522 (15.3°) |
Chemical Identifiers
| CAS Number | 578-58-5 |
|---|---|
| SMILES | CC1=CC=CC=C1OC |
| InChIKey | DTFKRVXLBCAIOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methylanisole (CAS 578-58-5), with molecular formula C8H10O and molecular weight 122.07 g/mol. IUPAC: 1-methoxy-2-methylbenzene.
Chemical Property Profile of 2-Methylanisole
Property Insights of 2-Methylanisole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylanisole. With a topological polar surface area (TPSA) of 9.2 Ų, 2-Methylanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylanisole 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 2-Methylanisole?
The CAS number of 2-Methylanisole is 578-58-5.
What is the molecular formula of 2-Methylanisole?
The molecular formula of 2-Methylanisole is C8H10O.
What is the molecular weight of 2-Methylanisole?
The molecular weight of 2-Methylanisole is 122.07 g/mol.
Where can I buy 2-Methylanisole?
You can request a quote for 2-Methylanisole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylanisole?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.