Vanadocene citrate
TL;DR: Vanadocene citrate (CAS 84822-40-2) is a chemical compound with molecular formula C16H17O7V-3 and molecular weight 372.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(cyclopenta-1,3-diene);hydron;2-hydroxypropane-1,2,3-tricarboxylate;vanadium
Also Known As: Vanadocene citrate, Vanadate(2-), bis(eta(sup 5)-2,4-cyclopentadien-1-yl)(2-hydroxy-1,2,3-propanetricarboxylato(3-))-, dihydrogen, cyclopenta-1,3-diene; hydron; 2-hydroxypropane-1,2,3-tricarboxylate; vanadium
| Molecular Formula | C16H17O7V-3 |
|---|---|
| Molecular Weight | 372.04 g/mol |
| LogP | -2.2191 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 372.04138 |
| Heavy Atoms | 24 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 84822-40-2 |
|---|---|
| SMILES | [H+].[H+].[CH-]1C=CC=C1.[CH-]1C=CC=C1.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[V] |
| InChIKey | QGJIYRRCLCCYPE-UHFFFAOYSA-M |
Product Overview
Vanadocene citrate (CAS 84822-40-2), with molecular formula C16H17O7V-3 and molecular weight 372.04 g/mol. IUPAC: bis(cyclopenta-1,3-diene);hydron;2-hydroxypropane-1,2,3-tricarboxylate;vanadium.
Chemical Property Profile of Vanadocene citrate
Property Insights of Vanadocene citrate
The XLogP value of -2.2191 indicates that Vanadocene citrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting Vanadocene citrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Vanadocene citrate has 3 hydrogen bond donor(s) and 9 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 Vanadocene citrate?
The CAS number of Vanadocene citrate is 84822-40-2.
What is the molecular formula of Vanadocene citrate?
The molecular formula of Vanadocene citrate is C16H17O7V-3.
What is the molecular weight of Vanadocene citrate?
The molecular weight of Vanadocene citrate is 372.04 g/mol.
Where can I buy Vanadocene citrate?
You can request a quote for Vanadocene citrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vanadocene citrate?
Yes, KEHONG BIO provides custom synthesis services for Vanadocene citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.