6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione
TL;DR: 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione (CAS 65461-27-0) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione
Also Known As: 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione, 10,10-dimethyl-2-methylidene-4-oxaspiro[4.5]decane-3,9-dione
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 354.0 |
Chemical Identifiers
| CAS Number | 65461-27-0 |
|---|---|
| SMILES | CC1(C(=O)CCCC12CC(=C)C(=O)O2)C |
| InChIKey | OLSRBXWEYHYVCK-UHFFFAOYSA-N |
Product Overview
6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione (CAS 65461-27-0), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 6,6-dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione.
Chemical Property Profile of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione
Property Insights of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione 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
Frequently Asked Questions
What is the CAS number of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione?
The CAS number of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione is 65461-27-0.
What is the molecular formula of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione?
The molecular formula of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione is C12H16O3.
What is the molecular weight of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione?
The molecular weight of 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione is 208.11 g/mol.
Where can I buy 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione?
You can request a quote for 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione?
Yes, KEHONG BIO provides custom synthesis services for 6,6-Dimethyl-3-methylidene-1-oxaspiro[4.5]decane-2,7-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.