Sulfobromophthalein Sodium
TL;DR: Sulfobromophthalein Sodium (CAS 71-67-0) is a chemical compound with molecular formula C20H8Br4Na2O10S2 and molecular weight 833.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate
Also Known As: Bromosulfalein, bromsulphthalein, Hepatosulfalein, Bromsulfalein, Hepatestabrome
| Molecular Formula | C20H8Br4Na2O10S2 |
|---|---|
| Molecular Weight | 833.61 g/mol |
| LogP | -1.57 |
| Topological Polar Surface Area | 198.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 837.6047 |
| Heavy Atoms | 38 |
| Complexity | 994.0 |
| Solubility | SOL IN WATER; INSOL IN ALCOHOL, ACETONE |
Chemical Identifiers
| CAS Number | 71-67-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C2(C3=C(C(=C(C(=C3Br)Br)Br)Br)C(=O)O2)C4=CC(=C(C=C4)O)S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Na+].[Na+] |
| InChIKey | GHAFORRTMVIXHS-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulfobromophthalein Sodium (CAS 71-67-0), with molecular formula C20H8Br4Na2O10S2 and molecular weight 833.61 g/mol. IUPAC: disodium;2-hydroxy-5-[4,5,6,7-tetrabromo-1-(4-hydroxy-3-sulfonatophenyl)-3-oxo-2-benzofuran-1-yl]benzenesulfonate.
Chemical Property Profile of Sulfobromophthalein Sodium
Property Insights of Sulfobromophthalein Sodium
The XLogP value of -1.57 indicates that Sulfobromophthalein Sodium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 198.0 Ų indicates high polarity, suggesting Sulfobromophthalein Sodium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sulfobromophthalein Sodium has 2 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 Sulfobromophthalein Sodium?
The CAS number of Sulfobromophthalein Sodium is 71-67-0.
What is the molecular formula of Sulfobromophthalein Sodium?
The molecular formula of Sulfobromophthalein Sodium is C20H8Br4Na2O10S2.
What is the molecular weight of Sulfobromophthalein Sodium?
The molecular weight of Sulfobromophthalein Sodium is 833.61 g/mol.
Where can I buy Sulfobromophthalein Sodium?
You can request a quote for Sulfobromophthalein Sodium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfobromophthalein Sodium?
Yes, KEHONG BIO provides custom synthesis services for Sulfobromophthalein Sodium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.