2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane
TL;DR: 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane (CAS 66408-78-4) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,6-dimethylhepta-1,5-dienyl)-1,3-dioxolane
Also Known As: Citracetal, Citral ethylene glycol acetal, Citral ethyleneglycol acetal, 2-(2,6-dimethylhepta-1,5-dienyl)-1,3-dioxolane, 1,3-DIOXOLANE, 2-(2,6-DIMETHYL-1,5-HEPTADIENYL)-
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H20O2 |
| Molecular Weight | 196.14633 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.14633 Da |
| Heavy Atoms | 14 |
| Complexity | 218.0 |
| SMILES | CC(=CCCC(=CC1OCCO1)C)C |
| InChIKey | KSDZVTNRVWBTFN-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane
Property Insights of 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane
The XLogP value of 3.2 indicates that 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane 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 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane?
The CAS number of 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane is 66408-78-4.
What is the molecular formula of 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane?
The molecular formula of 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane is C12H20O2.
What is the molecular weight of 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane?
The molecular weight of 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane is 196.14633 g/mol.
Where can I buy 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane?
You can request a quote for 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane?
Yes, CoreyChem provides custom synthesis services for 2-(2,6-Dimethylhepta-1,5-dienyl)-1,3-dioxolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.