Bicyclo(2.2.2)octane-2,6-dione
TL;DR: Bicyclo(2.2.2)octane-2,6-dione (CAS 38231-60-6) is a chemical compound with molecular formula C8H10O2 and molecular weight 138.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[2.2.2]octane-2,6-dione
Also Known As: Bicyclo[2.2.2]octane-2,6-dione, VXBMHPUAHFEJAV-UHFFFAOYSA-, bicyclo(2.2.2)octane-2,6-dione, bicyclo[2.2.2]octane-3,5-dione, Bicyclo[2.2.2]octane-2,7-dione
| Molecular Formula | C8H10O2 |
|---|---|
| Molecular Weight | 138.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.06808 |
| Heavy Atoms | 10 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 38231-60-6 |
|---|---|
| SMILES | C1CC2C(=O)CC1CC2=O |
| InChIKey | VXBMHPUAHFEJAV-UHFFFAOYSA-N |
Product Overview
Bicyclo(2.2.2)octane-2,6-dione (CAS 38231-60-6), with molecular formula C8H10O2 and molecular weight 138.07 g/mol. IUPAC: bicyclo[2.2.2]octane-2,6-dione.
Chemical Property Profile of Bicyclo(2.2.2)octane-2,6-dione
Property Insights of Bicyclo(2.2.2)octane-2,6-dione
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo(2.2.2)octane-2,6-dione. With a topological polar surface area (TPSA) of 34.1 Ų, Bicyclo(2.2.2)octane-2,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(2.2.2)octane-2,6-dione 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 Bicyclo(2.2.2)octane-2,6-dione?
The CAS number of Bicyclo(2.2.2)octane-2,6-dione is 38231-60-6.
What is the molecular formula of Bicyclo(2.2.2)octane-2,6-dione?
The molecular formula of Bicyclo(2.2.2)octane-2,6-dione is C8H10O2.
What is the molecular weight of Bicyclo(2.2.2)octane-2,6-dione?
The molecular weight of Bicyclo(2.2.2)octane-2,6-dione is 138.07 g/mol.
Where can I buy Bicyclo(2.2.2)octane-2,6-dione?
You can request a quote for Bicyclo(2.2.2)octane-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo(2.2.2)octane-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo(2.2.2)octane-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.