s-Indacene-1,3,5,7(2H,6H)-tetrone
TL;DR: s-Indacene-1,3,5,7(2H,6H)-tetrone (CAS 53910-13-7) is a chemical compound with molecular formula C12H6O4 and molecular weight 214.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
s-indacene-1,3,5,7-tetrone
Also Known As: s-Indacene-1,3,5,7(2H,6H)-tetrone, Janus dione, S-indacene-1,3,5,7-tetrone, s-Indacene-1,3,5,7(2H,6H)-tetraone, 1,3,5,7-Tetraoxo-s-hydrindacen
| Molecular Formula | C12H6O4 |
|---|---|
| Molecular Weight | 214.03 g/mol |
| LogP | 1.2248 |
| Topological Polar Surface Area | 68.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 214.02661 |
| Heavy Atoms | 16 |
| Complexity | 495.03146 |
Chemical Identifiers
| CAS Number | 53910-13-7 |
|---|---|
| SMILES | C1C(=O)C2=CC3=C(C=C2C1=O)C(=O)CC3=O |
Product Overview
s-Indacene-1,3,5,7(2H,6H)-tetrone (CAS 53910-13-7), with molecular formula C12H6O4 and molecular weight 214.03 g/mol. IUPAC: s-indacene-1,3,5,7-tetrone.
Chemical Property Profile of s-Indacene-1,3,5,7(2H,6H)-tetrone
Property Insights of s-Indacene-1,3,5,7(2H,6H)-tetrone
The XLogP value of 1.2248 suggests moderate lipophilicity, balancing water solubility and membrane permeability for s-Indacene-1,3,5,7(2H,6H)-tetrone. The TPSA of 68.28 Ų falls within the moderate polarity range, balancing permeability and solubility for s-Indacene-1,3,5,7(2H,6H)-tetrone. Following Lipinski's Rule of Five, s-Indacene-1,3,5,7(2H,6H)-tetrone 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 s-Indacene-1,3,5,7(2H,6H)-tetrone?
The CAS number of s-Indacene-1,3,5,7(2H,6H)-tetrone is 53910-13-7.
What is the molecular formula of s-Indacene-1,3,5,7(2H,6H)-tetrone?
The molecular formula of s-Indacene-1,3,5,7(2H,6H)-tetrone is C12H6O4.
What is the molecular weight of s-Indacene-1,3,5,7(2H,6H)-tetrone?
The molecular weight of s-Indacene-1,3,5,7(2H,6H)-tetrone is 214.03 g/mol.
Where can I buy s-Indacene-1,3,5,7(2H,6H)-tetrone?
You can request a quote for s-Indacene-1,3,5,7(2H,6H)-tetrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for s-Indacene-1,3,5,7(2H,6H)-tetrone?
Yes, KEHONG BIO provides custom synthesis services for s-Indacene-1,3,5,7(2H,6H)-tetrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.