Ferricenium trichloroacetate
TL;DR: Ferricenium trichloroacetate (CAS 12636-57-6) is a chemical compound with molecular formula C12H10Cl3FeO2-3 and molecular weight 346.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(cyclopenta-1,3-diene);iron;2,2,2-trichloroacetate
Also Known As: Ferricenium trichloroacetate, Ferrocenium Cl3acetate, Ferrocenium, salt with trichloroacetic acid (1:1), cyclopentane; iron; 2,2,2-trichloroacetic acid, Bis(.beta.^5-2,4-cyclopentadiene-1-yl)ferrocenium trichloroacetate
| Molecular Formula | C12H10Cl3FeO2-3 |
|---|---|
| Molecular Weight | 346.91 g/mol |
| LogP | 2.915 |
| Topological Polar Surface Area | 40.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 346.90958 |
| Heavy Atoms | 18 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 12636-57-6 |
|---|---|
| SMILES | [CH-]1C=CC=C1.[CH-]1C=CC=C1.C(=O)(C(Cl)(Cl)Cl)[O-].[Fe] |
| InChIKey | LZXJJUHMGQTOSQ-UHFFFAOYSA-M |
Product Overview
Ferricenium trichloroacetate (CAS 12636-57-6), with molecular formula C12H10Cl3FeO2-3 and molecular weight 346.91 g/mol. IUPAC: bis(cyclopenta-1,3-diene);iron;2,2,2-trichloroacetate.
Chemical Property Profile of Ferricenium trichloroacetate
Property Insights of Ferricenium trichloroacetate
The XLogP value of 2.915 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ferricenium trichloroacetate. With a topological polar surface area (TPSA) of 40.1 Ų, Ferricenium trichloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ferricenium trichloroacetate has 0 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 Ferricenium trichloroacetate?
The CAS number of Ferricenium trichloroacetate is 12636-57-6.
What is the molecular formula of Ferricenium trichloroacetate?
The molecular formula of Ferricenium trichloroacetate is C12H10Cl3FeO2-3.
What is the molecular weight of Ferricenium trichloroacetate?
The molecular weight of Ferricenium trichloroacetate is 346.91 g/mol.
Where can I buy Ferricenium trichloroacetate?
You can request a quote for Ferricenium trichloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ferricenium trichloroacetate?
Yes, KEHONG BIO provides custom synthesis services for Ferricenium trichloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.