Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)
TL;DR: Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) (CAS 68259-19-8) is a chemical compound with molecular formula C18H12Cl3FeO9S3 and molecular weight 628.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(4-chlorobenzenesulfonate);iron(3+)
Also Known As: Iron(III) p-chlorobenzenesulfonate, C6H5ClO3S.1/3Fe, iron(3+) tris(4-chlorobenzenesulfonate), Iron tris[p-chlorobenzenesulfonate], Benzenesulfonic acid, 4-chloro-, iron(3+) salt
| Molecular Formula | C18H12Cl3FeO9S3 |
|---|---|
| Molecular Weight | 628.81 g/mol |
| LogP | 3.73 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 628.80585 |
| Heavy Atoms | 34 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 68259-19-8 |
|---|---|
| SMILES | C1=CC(=CC=C1S(=O)(=O)[O-])Cl.C1=CC(=CC=C1S(=O)(=O)[O-])Cl.C1=CC(=CC=C1S(=O)(=O)[O-])Cl.[Fe+3] |
| InChIKey | PRJPIUKZPYHOGP-UHFFFAOYSA-K |
Product Overview
Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) (CAS 68259-19-8), with molecular formula C18H12Cl3FeO9S3 and molecular weight 628.81 g/mol. IUPAC: tris(4-chlorobenzenesulfonate);iron(3+).
Chemical Property Profile of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)
Property Insights of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)
The XLogP value of 3.73 indicates that Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 197.0 Ų indicates high polarity, suggesting Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)?
The CAS number of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) is 68259-19-8.
What is the molecular formula of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)?
The molecular formula of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) is C18H12Cl3FeO9S3.
What is the molecular weight of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)?
The molecular weight of Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) is 628.81 g/mol.
Where can I buy Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)?
You can request a quote for Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 4-chloro-, iron(3+) salt (3:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.