5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane
TL;DR: 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane (CAS 22645-42-7) is a chemical compound with molecular formula C12H24O3 and molecular weight 216.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(methoxymethyl)-2-propan-2-yl-5-propyl-1,3-dioxane
Also Known As: cis-2-Isopropyl-5-(methoxymethyl)-5-propyl-1,3-dioxane, 5-(methoxymethyl)-2-propan-2-yl-5-propyl-1,3-dioxane, trans-2-Isopropyl-5-(methoxymethyl)-5-propyl-1,3-dioxane, m-DIOXANE, 2-ISOPROPYL-5-(METHOXYMETHYL)-5-PROPYL-, (Z)-, 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane
Technical Specifications
| Molecular Formula | C12H24O3 |
| Molecular Weight | 216.17255 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 216.17255 Da |
| Heavy Atoms | 15 |
| Complexity | 172.0 |
| SMILES | CCCC1(COC(OC1)C(C)C)COC |
| InChIKey | TXVWJQUUWDTJRT-UHFFFAOYSA-N |
Chemical Property Profile of 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane
Property Insights of 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane. With a topological polar surface area (TPSA) of 27.7 Ų, 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane has 0 hydrogen bond donor(s) and 3 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-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane?
The CAS number of 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane is 22645-42-7.
What is the molecular formula of 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane?
The molecular formula of 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane is C12H24O3.
What is the molecular weight of 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane?
The molecular weight of 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane is 216.17255 g/mol.
Where can I buy 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane?
You can request a quote for 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane?
Yes, CoreyChem provides custom synthesis services for 5-(Methoxymethyl)-2-(propan-2-yl)-5-propyl-1,3-dioxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.