5-Ethyl-2-(propan-2-yl)-1,3-dioxane
TL;DR: 5-Ethyl-2-(propan-2-yl)-1,3-dioxane (CAS 22645-27-8) is a chemical compound with molecular formula C9H18O2 and molecular weight 158.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-2-propan-2-yl-1,3-dioxane
Also Known As: (2E)-hexadecenal, cis-5-Ethyl-2-isopropyl-1,3-dioxane, trans-5-Ethyl-2-isopropyl-1,3-dioxane, 5-Ethyl-2-isopropyl-[1,3]dioxane, 5-ethyl-2-(propan-2-yl)-1,3-dioxane
Technical Specifications
| Molecular Formula | C9H18O2 |
| Molecular Weight | 158.13068 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.13068 Da |
| Heavy Atoms | 11 |
| Complexity | 104.0 |
| SMILES | CCC1COC(OC1)C(C)C |
| InChIKey | LOVWNVWPXIBGIX-UHFFFAOYSA-N |
Chemical Property Profile of 5-Ethyl-2-(propan-2-yl)-1,3-dioxane
Property Insights of 5-Ethyl-2-(propan-2-yl)-1,3-dioxane
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-2-(propan-2-yl)-1,3-dioxane. With a topological polar surface area (TPSA) of 18.5 Ų, 5-Ethyl-2-(propan-2-yl)-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-2-(propan-2-yl)-1,3-dioxane 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 5-Ethyl-2-(propan-2-yl)-1,3-dioxane?
The CAS number of 5-Ethyl-2-(propan-2-yl)-1,3-dioxane is 22645-27-8.
What is the molecular formula of 5-Ethyl-2-(propan-2-yl)-1,3-dioxane?
The molecular formula of 5-Ethyl-2-(propan-2-yl)-1,3-dioxane is C9H18O2.
What is the molecular weight of 5-Ethyl-2-(propan-2-yl)-1,3-dioxane?
The molecular weight of 5-Ethyl-2-(propan-2-yl)-1,3-dioxane is 158.13068 g/mol.
Where can I buy 5-Ethyl-2-(propan-2-yl)-1,3-dioxane?
You can request a quote for 5-Ethyl-2-(propan-2-yl)-1,3-dioxane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Ethyl-2-(propan-2-yl)-1,3-dioxane?
Yes, CoreyChem provides custom synthesis services for 5-Ethyl-2-(propan-2-yl)-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.