8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate
TL;DR: 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate (CAS 18926-91-5) is a chemical compound with molecular formula C12H18O5 and molecular weight 242.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8,8-dimethoxy-5-oxo-1-bicyclo[4.2.0]octanyl) acetate
Also Known As: 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate, (7,7-dimethoxy-2-oxo-6-bicyclo[4.2.0]octanyl) acetate, 8,8-Dimethoxy-5-oxobicyclo[4.2.0]oct-1-yl acetate, 6-Acetoxy-7,7-dimethoxy-bicyclo[4.2.0]-octan-2-on, 8,8-DIMETHOXY-5-OXOBICYCLO[4.2.0]OCTAN-1-YL ACETATE
| Molecular Formula | C12H18O5 |
|---|---|
| Molecular Weight | 242.12 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.11542 |
| Heavy Atoms | 17 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 18926-91-5 |
|---|---|
| SMILES | CC(=O)OC12CCCC(=O)C1CC2(OC)OC |
| InChIKey | OPLKKLZDAMJIFB-UHFFFAOYSA-N |
Product Overview
8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate (CAS 18926-91-5), with molecular formula C12H18O5 and molecular weight 242.12 g/mol. IUPAC: (8,8-dimethoxy-5-oxo-1-bicyclo[4.2.0]octanyl) acetate.
Chemical Property Profile of 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate
Property Insights of 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate. Following Lipinski's Rule of Five, 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate has 0 hydrogen bond donor(s) and 5 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 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate?
The CAS number of 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate is 18926-91-5.
What is the molecular formula of 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate?
The molecular formula of 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate is C12H18O5.
What is the molecular weight of 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate?
The molecular weight of 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate is 242.12 g/mol.
Where can I buy 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate?
You can request a quote for 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 8,8-Dimethoxy-5-oxobicyclo(4.2.0)oct-1-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.