1-Ethoxy-2-methoxy-4-methylbenzene
TL;DR: 1-Ethoxy-2-methoxy-4-methylbenzene (CAS 33963-27-8) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethoxy-2-methoxy-4-methylbenzene
Also Known As: 1-Ethoxy-2-methoxy-4-methylbenzene, 4-Ethoxy-3-methoxytoluene, Benzene, 1-ethoxy-2-methoxy-4-methyl-, QOFRRWWZQIIACS-UHFFFAOYSA-, 1-ethoxy-2-methoxy-4-methyl-benzene
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 33963-27-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C)OC |
| InChIKey | QOFRRWWZQIIACS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethoxy-2-methoxy-4-methylbenzene (CAS 33963-27-8), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 1-ethoxy-2-methoxy-4-methylbenzene.
Chemical Property Profile of 1-Ethoxy-2-methoxy-4-methylbenzene
Property Insights of 1-Ethoxy-2-methoxy-4-methylbenzene
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethoxy-2-methoxy-4-methylbenzene. With a topological polar surface area (TPSA) of 18.5 Ų, 1-Ethoxy-2-methoxy-4-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethoxy-2-methoxy-4-methylbenzene 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 1-Ethoxy-2-methoxy-4-methylbenzene?
The CAS number of 1-Ethoxy-2-methoxy-4-methylbenzene is 33963-27-8.
What is the molecular formula of 1-Ethoxy-2-methoxy-4-methylbenzene?
The molecular formula of 1-Ethoxy-2-methoxy-4-methylbenzene is C10H14O2.
What is the molecular weight of 1-Ethoxy-2-methoxy-4-methylbenzene?
The molecular weight of 1-Ethoxy-2-methoxy-4-methylbenzene is 166.10 g/mol.
Where can I buy 1-Ethoxy-2-methoxy-4-methylbenzene?
You can request a quote for 1-Ethoxy-2-methoxy-4-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethoxy-2-methoxy-4-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethoxy-2-methoxy-4-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.