5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane
TL;DR: 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane (CAS 707-29-9) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-1,5-dioxaspiro[5.5]undecane
Also Known As: thyme undecane, 3,3-Dimethyl-1,5-dioxaspiro[5.5]undecane, 1,5-Dioxaspiro[5.5]undecane, 3,3-dimethyl-, 1, 3,3-dimethyl-, 1,5-Dioxaspiro[5.5]undecane,3,3-dimethyl-
| Molecular Formula | C11H20O2 |
|---|---|
| Molecular Weight | 184.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.14633 |
| Heavy Atoms | 13 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 707-29-9 |
|---|---|
| SMILES | CC1(COC2(CCCCC2)OC1)C |
| InChIKey | QIFSGRPJUXQGMD-UHFFFAOYSA-N |
Product Overview
5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane (CAS 707-29-9), with molecular formula C11H20O2 and molecular weight 184.15 g/mol. IUPAC: 3,3-dimethyl-1,5-dioxaspiro[5.5]undecane.
Chemical Property Profile of 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane
Property Insights of 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane. With a topological polar surface area (TPSA) of 18.5 Ų, 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane 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 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane?
The CAS number of 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane is 707-29-9.
What is the molecular formula of 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane?
The molecular formula of 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane is C11H20O2.
What is the molecular weight of 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane?
The molecular weight of 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane is 184.15 g/mol.
Where can I buy 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane?
You can request a quote for 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dimethyl-1,3-dioxane-2-spirocyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.