5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione
TL;DR: 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS 3968-30-7) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione
Also Known As: 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione, J3.781.213G, 1,3-Dioxane-4,6-dione,5-cyclopentylidene-2,2-dimethyl-, 5-cyclopentylidene-2,2-dimethyl-[1,3]dioxane-4,6-dione, RefChem:302743
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 3968-30-7 |
|---|---|
| SMILES | CC1(OC(=O)C(=C2CCCC2)C(=O)O1)C |
| InChIKey | UNLICWFXGAYRLK-UHFFFAOYSA-N |
Product Overview
5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione (CAS 3968-30-7), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: 5-cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione.
Chemical Property Profile of 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione
Property Insights of 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione. With a topological polar surface area (TPSA) of 52.6 Ų, 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione has 0 hydrogen bond donor(s) and 4 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-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione?
The CAS number of 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione is 3968-30-7.
What is the molecular formula of 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione?
The molecular formula of 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione is C11H14O4.
What is the molecular weight of 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione?
The molecular weight of 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione is 210.09 g/mol.
Where can I buy 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione?
You can request a quote for 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Cyclopentylidene-2,2-dimethyl-1,3-dioxane-4,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.