3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione
TL;DR: 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione (CAS 16191-17-6) is a chemical compound with molecular formula C4H2O4 and molecular weight 114.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-dioxabicyclo[3.1.0]hexane-2,4-dione
Also Known As: 3,6-dioxabicyclo[3.1.0]hexane-2,4-dione, 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione, 3,6-Dioxabicyclo[3.1.0]hexane-2,4-dione(9CI), J2.200.866H, 3,6-Dioxabicyclo[3.1.0]hexane-2,4-dione (9CI)
| Molecular Formula | C4H2O4 |
|---|---|
| Molecular Weight | 114.00 g/mol |
| LogP | -1.1628 |
| Topological Polar Surface Area | 55.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 113.99531 |
| Heavy Atoms | 8 |
| Complexity | 154.87712 |
Chemical Identifiers
| CAS Number | 16191-17-6 |
|---|---|
| SMILES | C12C(O1)C(=O)OC2=O |
Product Overview
3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione (CAS 16191-17-6), with molecular formula C4H2O4 and molecular weight 114.00 g/mol. IUPAC: 3,6-dioxabicyclo[3.1.0]hexane-2,4-dione.
Chemical Property Profile of 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione
Property Insights of 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione
The XLogP value of -1.1628 indicates that 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.9 Ų, 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,6-Dioxabicyclo(3.1.0)hexane-2,4-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 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione?
The CAS number of 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione is 16191-17-6.
What is the molecular formula of 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione?
The molecular formula of 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione is C4H2O4.
What is the molecular weight of 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione?
The molecular weight of 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione is 114.00 g/mol.
Where can I buy 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione?
You can request a quote for 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,6-Dioxabicyclo(3.1.0)hexane-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.