6,8-Dioxabicyclo(3.2.1)octan-7-one
TL;DR: 6,8-Dioxabicyclo(3.2.1)octan-7-one (CAS 5257-20-5) is a chemical compound with molecular formula C6H8O3 and molecular weight 128.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dioxabicyclo[3.2.1]octan-7-one
Also Known As: 6,8-Dioxabicyclo[3.2.1]octan-7-one, 7,8-dioxabicyclo[3.2.1]octan-6-one, 7,8-Dioxabicyclo(3.2.1)octan-6-one, 6-Hydroxytetrahydropyran-2-carboxylic acid lactone, 6,8-DIOXABICYCLO(3.2.1)OCTAN-7-ONE
| Molecular Formula | C6H8O3 |
|---|---|
| Molecular Weight | 128.05 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.04735 |
| Heavy Atoms | 9 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 5257-20-5 |
|---|---|
| SMILES | C1CC2C(=O)OC(C1)O2 |
| InChIKey | FDTQYEHORIQWRC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6,8-Dioxabicyclo(3.2.1)octan-7-one (CAS 5257-20-5), with molecular formula C6H8O3 and molecular weight 128.05 g/mol. IUPAC: 6,8-dioxabicyclo[3.2.1]octan-7-one.
Chemical Property Profile of 6,8-Dioxabicyclo(3.2.1)octan-7-one
Property Insights of 6,8-Dioxabicyclo(3.2.1)octan-7-one
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,8-Dioxabicyclo(3.2.1)octan-7-one. With a topological polar surface area (TPSA) of 35.5 Ų, 6,8-Dioxabicyclo(3.2.1)octan-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-Dioxabicyclo(3.2.1)octan-7-one 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 6,8-Dioxabicyclo(3.2.1)octan-7-one?
The CAS number of 6,8-Dioxabicyclo(3.2.1)octan-7-one is 5257-20-5.
What is the molecular formula of 6,8-Dioxabicyclo(3.2.1)octan-7-one?
The molecular formula of 6,8-Dioxabicyclo(3.2.1)octan-7-one is C6H8O3.
What is the molecular weight of 6,8-Dioxabicyclo(3.2.1)octan-7-one?
The molecular weight of 6,8-Dioxabicyclo(3.2.1)octan-7-one is 128.05 g/mol.
Where can I buy 6,8-Dioxabicyclo(3.2.1)octan-7-one?
You can request a quote for 6,8-Dioxabicyclo(3.2.1)octan-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-Dioxabicyclo(3.2.1)octan-7-one?
Yes, KEHONG BIO provides custom synthesis services for 6,8-Dioxabicyclo(3.2.1)octan-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.