(5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate
TL;DR: (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate (CAS 58976-82-2) is a chemical compound with molecular formula C20H14O6 and molecular weight 350.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5,6,11,12-tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate
Also Known As: (5,6,11,12-tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate, (5,6,11,12-tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acet, 5,6,11,12-Naphthacenetetrone,1-(acetyloxy)-1,4,4a,12a-tetrahydro-, 5,6,11,12-tetraoxo-1,4,4a,5,6,11,12,12a-octahydrotetracen-1-yl acetate
| Molecular Formula | C20H14O6 |
|---|---|
| Molecular Weight | 350.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 350.07904 |
| Heavy Atoms | 26 |
| Complexity | 801.0 |
Chemical Identifiers
| CAS Number | 58976-82-2 |
|---|---|
| SMILES | CC(=O)OC1C=CCC2C1C(=O)C3=C(C2=O)C(=O)C4=CC=CC=C4C3=O |
| InChIKey | ZWBPPZICKXFYCI-UHFFFAOYSA-N |
Product Overview
(5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate (CAS 58976-82-2), with molecular formula C20H14O6 and molecular weight 350.08 g/mol. IUPAC: (5,6,11,12-tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate.
Chemical Property Profile of (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate
Property Insights of (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate. Following Lipinski's Rule of Five, (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate has 0 hydrogen bond donor(s) and 6 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 (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate?
The CAS number of (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate is 58976-82-2.
What is the molecular formula of (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate?
The molecular formula of (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate is C20H14O6.
What is the molecular weight of (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate?
The molecular weight of (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate is 350.08 g/mol.
Where can I buy (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate?
You can request a quote for (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-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 (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (5,6,11,12-Tetraoxo-1,4,4a,12a-tetrahydrotetracen-1-yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.