1,2-Diethoxy-4-ethylbenzene
TL;DR: 1,2-Diethoxy-4-ethylbenzene (CAS 131358-04-8) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-diethoxy-4-ethylbenzene
Also Known As: 1,2-Diethoxy-4-ethylbenzene, 1,2-Diethoxy-4-ethyl benzene, Benzene, 1,2-diethoxy-4-ethyl
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.13068 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.13068 Da |
| Heavy Atoms | 14 |
| Complexity | 147.0 |
| SMILES | CCC1=CC(=C(C=C1)OCC)OCC |
| InChIKey | UBLKIWURCMXRBT-UHFFFAOYSA-N |
Chemical Property Profile of 1,2-Diethoxy-4-ethylbenzene
Property Insights of 1,2-Diethoxy-4-ethylbenzene
The XLogP value of 3.0 indicates that 1,2-Diethoxy-4-ethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,2-Diethoxy-4-ethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Diethoxy-4-ethylbenzene 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
What is the CAS number of 1,2-Diethoxy-4-ethylbenzene?
The CAS number of 1,2-Diethoxy-4-ethylbenzene is 131358-04-8.
What is the molecular formula of 1,2-Diethoxy-4-ethylbenzene?
The molecular formula of 1,2-Diethoxy-4-ethylbenzene is C12H18O2.
What is the molecular weight of 1,2-Diethoxy-4-ethylbenzene?
The molecular weight of 1,2-Diethoxy-4-ethylbenzene is 194.13068 g/mol.
Where can I buy 1,2-Diethoxy-4-ethylbenzene?
You can request a quote for 1,2-Diethoxy-4-ethylbenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2-Diethoxy-4-ethylbenzene?
Yes, CoreyChem provides custom synthesis services for 1,2-Diethoxy-4-ethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.