Trisodium fluorocitrate
TL;DR: Trisodium fluorocitrate (CAS 3834-35-3) is a chemical compound with molecular formula C6H4FNa3O7 and molecular weight 275.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;1-fluoro-2-hydroxypropane-1,2,3-tricarboxylate
Also Known As: Trisodium fluorocitrate, 2-Methylcortisone, Sodium fluorocitrate, Citric acid, fluoro-, trisodium salt, Trisodium 3-C-carboxylato-2,4-dideoxy-2-fluoropentarate
| Molecular Formula | C6H4FNa3O7 |
|---|---|
| Molecular Weight | 275.96 g/mol |
| LogP | -14.2926 |
| Topological Polar Surface Area | 140.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.9634 |
| Heavy Atoms | 17 |
| Complexity | 286.7826 |
Chemical Identifiers
| CAS Number | 3834-35-3 |
|---|---|
| SMILES | C(C(=O)[O-])C(C(C(=O)[O-])F)(C(=O)[O-])O.[Na+].[Na+].[Na+] |
Product Overview
Trisodium fluorocitrate (CAS 3834-35-3), with molecular formula C6H4FNa3O7 and molecular weight 275.96 g/mol. IUPAC: trisodium;1-fluoro-2-hydroxypropane-1,2,3-tricarboxylate.
Chemical Property Profile of Trisodium fluorocitrate
Property Insights of Trisodium fluorocitrate
The XLogP value of -14.2926 indicates that Trisodium fluorocitrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.62 Ų indicates high polarity, suggesting Trisodium fluorocitrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trisodium fluorocitrate has 1 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 Trisodium fluorocitrate?
The CAS number of Trisodium fluorocitrate is 3834-35-3.
What is the molecular formula of Trisodium fluorocitrate?
The molecular formula of Trisodium fluorocitrate is C6H4FNa3O7.
What is the molecular weight of Trisodium fluorocitrate?
The molecular weight of Trisodium fluorocitrate is 275.96 g/mol.
Where can I buy Trisodium fluorocitrate?
You can request a quote for Trisodium fluorocitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trisodium fluorocitrate?
Yes, KEHONG BIO provides custom synthesis services for Trisodium fluorocitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.