Disodium endothal
TL;DR: Disodium endothal (CAS 13114-29-9) is a chemical compound with molecular formula C8H8Na2O5 and molecular weight 230.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylate
Also Known As: Endothal-disodium, Accelerate, Aguathol, Sodium Demethylcantharidate, Aquathol
| Molecular Formula | C8H8Na2O5 |
|---|---|
| Molecular Weight | 230.02 g/mol |
| LogP | -8.71 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 230.01671 |
| Heavy Atoms | 15 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 13114-29-9 |
|---|---|
| SMILES | C1CC2C(C(C1O2)C(=O)[O-])C(=O)[O-].[Na+].[Na+] |
| InChIKey | XRHVZWWRFMCBAZ-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Disodium endothal (CAS 13114-29-9), with molecular formula C8H8Na2O5 and molecular weight 230.02 g/mol. IUPAC: disodium;7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylate.
Chemical Property Profile of Disodium endothal
Property Insights of Disodium endothal
The XLogP value of -8.71 indicates that Disodium endothal is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Disodium endothal. Following Lipinski's Rule of Five, Disodium endothal has 0 hydrogen bond donor(s) and 5 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 Disodium endothal?
The CAS number of Disodium endothal is 13114-29-9.
What is the molecular formula of Disodium endothal?
The molecular formula of Disodium endothal is C8H8Na2O5.
What is the molecular weight of Disodium endothal?
The molecular weight of Disodium endothal is 230.02 g/mol.
Where can I buy Disodium endothal?
You can request a quote for Disodium endothal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium endothal?
Yes, KEHONG BIO provides custom synthesis services for Disodium endothal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.