Trisodium sulphonatophthalate
TL;DR: Trisodium sulphonatophthalate (CAS 52642-40-7) is a chemical compound with molecular formula C8H3Na3O7S and molecular weight 311.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;3-sulfonatophthalate
Also Known As: Trisodium sulphonatophthalate, EINECS 258-066-3, trisodium 3-sulfonatophthalate, trisodium,3-sulfonatophthalate, SULFOPHTHALIC ACID TRISODIUM SALT
| Molecular Formula | C8H3Na3O7S |
|---|---|
| Molecular Weight | 311.93 g/mol |
| LogP | -11.6703 |
| Topological Polar Surface Area | 137.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.92926 |
| Heavy Atoms | 19 |
| Complexity | 569.7053 |
Chemical Identifiers
| CAS Number | 52642-40-7 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)S(=O)(=O)[O-])C(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+] |
Product Overview
Trisodium sulphonatophthalate (CAS 52642-40-7), with molecular formula C8H3Na3O7S and molecular weight 311.93 g/mol. IUPAC: trisodium;3-sulfonatophthalate.
Chemical Property Profile of Trisodium sulphonatophthalate
Property Insights of Trisodium sulphonatophthalate
The XLogP value of -11.6703 indicates that Trisodium sulphonatophthalate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 137.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Trisodium sulphonatophthalate. Following Lipinski's Rule of Five, Trisodium sulphonatophthalate has 0 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 sulphonatophthalate?
The CAS number of Trisodium sulphonatophthalate is 52642-40-7.
What is the molecular formula of Trisodium sulphonatophthalate?
The molecular formula of Trisodium sulphonatophthalate is C8H3Na3O7S.
What is the molecular weight of Trisodium sulphonatophthalate?
The molecular weight of Trisodium sulphonatophthalate is 311.93 g/mol.
Where can I buy Trisodium sulphonatophthalate?
You can request a quote for Trisodium sulphonatophthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trisodium sulphonatophthalate?
Yes, KEHONG BIO provides custom synthesis services for Trisodium sulphonatophthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.