1,6-二氧杂螺［4.4］壬烷-2,7-二酮
TL;DR: 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 (CAS 3505-67-7) is a chemical compound with molecular formula C7H8O4 and molecular weight 156.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,6-二氧杂螺［4.4］壬烷-2,7-二酮
1,6-dioxaspiro[4.4]nonane-2,7-dione
Also Known As: 1,6-Dioxaspiro[4.4]nonane-2,7-dione, Spirodilactone, 1,6-Dioxaspiro(4.4)nonane-2,7-dione, VTQYOGUFKHVWOO-UHFFFAOYSA-, 4,4-Dihydroxypimelic acid dilactone
| Molecular Formula | C7H8O4 |
|---|---|
| Molecular Weight | 156.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.04225 |
| Heavy Atoms | 11 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 3505-67-7 |
|---|---|
| SMILES | C1CC2(CCC(=O)O2)OC1=O |
| InChIKey | VTQYOGUFKHVWOO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,6-二氧杂螺［4.4］壬烷-2,7-二酮 (CAS 3505-67-7), with molecular formula C7H8O4 and molecular weight 156.04 g/mol. IUPAC: 1,6-dioxaspiro[4.4]nonane-2,7-dione.
Chemical Property Profile of 1,6-二氧杂螺［4.4］壬烷-2,7-二酮
Property Insights of 1,6-二氧杂螺［4.4］壬烷-2,7-二酮
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-二氧杂螺［4.4］壬烷-2,7-二酮. With a topological polar surface area (TPSA) of 52.6 Ų, 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 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 1,6-二氧杂螺［4.4］壬烷-2,7-二酮?
The CAS number of 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 is 3505-67-7.
What is the molecular formula of 1,6-二氧杂螺［4.4］壬烷-2,7-二酮?
The molecular formula of 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 is C7H8O4.
What is the molecular weight of 1,6-二氧杂螺［4.4］壬烷-2,7-二酮?
The molecular weight of 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 is 156.04 g/mol.
Where can I buy 1,6-二氧杂螺［4.4］壬烷-2,7-二酮?
You can request a quote for 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,6-二氧杂螺［4.4］壬烷-2,7-二酮?
Yes, KEHONG BIO provides custom synthesis services for 1,6-二氧杂螺［4.4］壬烷-2,7-二酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.