5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid
TL;DR: 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid (CAS 23613-32-3) is a chemical compound with molecular formula C14H8O6S and molecular weight 304.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dioxodibenzothiophene-3,7-dicarboxylic acid
Also Known As: H2dbtdcO2, YSZC227, 5,5-Dioxo-5H-dibenzo[b,d]thiophene-3,7-dicarboxylic acid, 5,5-dioxodibenzothiophene-3,7-dicarboxylic acid, 3,7-Dibenzothiophenedicarboxylic acid, 5,5-dioxide
| Molecular Formula | C14H8O6S |
|---|---|
| Molecular Weight | 304.00 g/mol |
| LogP | 1.8962 |
| Topological Polar Surface Area | 108.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 304.00415 |
| Heavy Atoms | 21 |
| Complexity | 841.55664 |
Chemical Identifiers
| CAS Number | 23613-32-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1C(=O)O)S(=O)(=O)C3=C2C=CC(=C3)C(=O)O |
Product Overview
5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid (CAS 23613-32-3), with molecular formula C14H8O6S and molecular weight 304.00 g/mol. IUPAC: 5,5-dioxodibenzothiophene-3,7-dicarboxylic acid.
Chemical Property Profile of 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid
Property Insights of 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid
The XLogP value of 1.8962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid. The TPSA of 108.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid. Following Lipinski's Rule of Five, 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid has 2 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 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid?
The CAS number of 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid is 23613-32-3.
What is the molecular formula of 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid?
The molecular formula of 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid is C14H8O6S.
What is the molecular weight of 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid?
The molecular weight of 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid is 304.00 g/mol.
Where can I buy 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid?
You can request a quote for 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,5-Dioxodibenzothiophene-3,7-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.