Rufianic acid
TL;DR: Rufianic acid (CAS 145-48-2) is a chemical compound with molecular formula C14H8O7S and molecular weight 320.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dihydroxy-9,10-dioxoanthracene-2-sulfonic acid
Also Known As: Rufianic acid, Rufiansaure, Quinizarinsulfonic acid, 1,4-Dihydroxyanthraquinone-2-sulfonic acid, Helio Fast Rubine 4BLA
| Molecular Formula | C14H8O7S |
|---|---|
| Molecular Weight | 320.00 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 319.99908 |
| Heavy Atoms | 22 |
| Complexity | 593.0 |
Chemical Identifiers
| CAS Number | 145-48-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)S(=O)(=O)O)O |
| InChIKey | CCQSBGJULPBARL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Rufianic acid (CAS 145-48-2), with molecular formula C14H8O7S and molecular weight 320.00 g/mol. IUPAC: 1,4-dihydroxy-9,10-dioxoanthracene-2-sulfonic acid.
Chemical Property Profile of Rufianic acid
Property Insights of Rufianic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rufianic acid. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Rufianic acid. Following Lipinski's Rule of Five, Rufianic acid has 3 hydrogen bond donor(s) and 7 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 Rufianic acid?
The CAS number of Rufianic acid is 145-48-2.
What is the molecular formula of Rufianic acid?
The molecular formula of Rufianic acid is C14H8O7S.
What is the molecular weight of Rufianic acid?
The molecular weight of Rufianic acid is 320.00 g/mol.
Where can I buy Rufianic acid?
You can request a quote for Rufianic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rufianic acid?
Yes, KEHONG BIO provides custom synthesis services for Rufianic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.