![2-[(3,5-Dimethylphenoxy)methyl]oxirane structure](/static/products/4287/4287-30-3.webp)
2-[(3,5-Dimethylphenoxy)methyl]oxirane
TL;DR: 2-[(3,5-Dimethylphenoxy)methyl]oxirane (CAS 4287-30-3) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dimethylphenoxy)methyl]oxirane
Also Known As: 2-[(3,5-Dimethylphenoxy)methyl]oxirane, 2-(3,5-dimethylphenoxymethyl)oxirane, Metaxalone Impurity 9, 3,5-Dimethylphenoxymethyloxirane, Glycidyl 3,5-xylyl ether
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 4287-30-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OCC2CO2)C |
| InChIKey | ALJXKSOYHMOQSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(3,5-Dimethylphenoxy)methyl]oxirane (CAS 4287-30-3), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: 2-[(3,5-dimethylphenoxy)methyl]oxirane.
Chemical Property Profile of 2-[(3,5-Dimethylphenoxy)methyl]oxirane
Property Insights of 2-[(3,5-Dimethylphenoxy)methyl]oxirane
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3,5-Dimethylphenoxy)methyl]oxirane. With a topological polar surface area (TPSA) of 21.8 Ų, 2-[(3,5-Dimethylphenoxy)methyl]oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(3,5-Dimethylphenoxy)methyl]oxirane has 0 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-[(3,5-Dimethylphenoxy)methyl]oxirane?
The CAS number of 2-[(3,5-Dimethylphenoxy)methyl]oxirane is 4287-30-3.
What is the molecular formula of 2-[(3,5-Dimethylphenoxy)methyl]oxirane?
The molecular formula of 2-[(3,5-Dimethylphenoxy)methyl]oxirane is C11H14O2.
What is the molecular weight of 2-[(3,5-Dimethylphenoxy)methyl]oxirane?
The molecular weight of 2-[(3,5-Dimethylphenoxy)methyl]oxirane is 178.10 g/mol.
Where can I buy 2-[(3,5-Dimethylphenoxy)methyl]oxirane?
You can request a quote for 2-[(3,5-Dimethylphenoxy)methyl]oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(3,5-Dimethylphenoxy)methyl]oxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-[(3,5-Dimethylphenoxy)methyl]oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.