Ferrospectral
TL;DR: Ferrospectral (CAS 28048-33-1) is a chemical compound with molecular formula C20H12N4Na2O6S2 and molecular weight 514.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-[3-pyridin-2-yl-6-(4-sulfonatophenyl)-1,2,4-triazin-5-yl]benzenesulfonate
Also Known As: FERROZINE, Ferrozine Disodium Salt, Ferrospectral, Ferrozin, Ferrozine sodium
| Molecular Formula | C20H12N4Na2O6S2 |
|---|---|
| Molecular Weight | 514.00 g/mol |
| LogP | -3.92 |
| Topological Polar Surface Area | 183.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 513.9994 |
| Heavy Atoms | 34 |
| Complexity | 800.0 |
Chemical Identifiers
| CAS Number | 28048-33-1 |
|---|---|
| SMILES | C1=CC=NC(=C1)C2=NC(=C(N=N2)C3=CC=C(C=C3)S(=O)(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | DDIHLFCSEHAOJZ-UHFFFAOYSA-L |
Product Overview
Ferrospectral (CAS 28048-33-1), with molecular formula C20H12N4Na2O6S2 and molecular weight 514.00 g/mol. IUPAC: disodium;4-[3-pyridin-2-yl-6-(4-sulfonatophenyl)-1,2,4-triazin-5-yl]benzenesulfonate.
Chemical Property Profile of Ferrospectral
Property Insights of Ferrospectral
The XLogP value of -3.92 indicates that Ferrospectral is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 183.0 Ų indicates high polarity, suggesting Ferrospectral may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ferrospectral has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ferrospectral?
The CAS number of Ferrospectral is 28048-33-1.
What is the molecular formula of Ferrospectral?
The molecular formula of Ferrospectral is C20H12N4Na2O6S2.
What is the molecular weight of Ferrospectral?
The molecular weight of Ferrospectral is 514.00 g/mol.
Where can I buy Ferrospectral?
You can request a quote for Ferrospectral directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ferrospectral?
Yes, KEHONG BIO provides custom synthesis services for Ferrospectral and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.