RefChem:88613
TL;DR: RefChem:88613 (CAS 68227-44-1) is a chemical compound with molecular formula C36H22N7Na3O10S3 and molecular weight 877.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;8-[[4-[[4-[(4-aminophenyl)diazenyl]-6-sulfonatonaphthalen-1-yl]diazenyl]-6-sulfonatonaphthalen-1-yl]diazenyl]-7-hydroxynaphthalene-2-sulfonate
Also Known As: 2-Naphthalenesulfonic acid, 8-((4-((4-aminophenyl)azo)-6-sulfo-1-naphthalenyl)azo)-5-((2-hydroxy-7-sulfo-1-naphthalenyl)azo)-, trisodium salt, 2-Naphthalenesulfonic acid, 8-(2-(4-(2-(4-aminophenyl)diazenyl)-6-sulfo-1-naphthalenyl)diazenyl)-5-(2-(2-hydroxy-7-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:3), 2-Naphthalenesulfonic acid, 8-[2-[4-[2-(4-aminophenyl)diazenyl]-6-sulfo-1-naphthalenyl]diazenyl]-5-[2-(2-hydroxy-7-sulfo-1-naphthalenyl)diazenyl]-, sodium salt (1:3), 8-((4-((4-((p-Aminophenyl)azo)-6-sulfo-1-naphthyl)azo)-6-sulfo-1-naphthyl)azo)-7-hydroxy-2-naphthalenesulfonic acid, trisodium salt, Trisodium 8-((4-((4-aminophenyl)azo)-6-sulphonatonaphthyl)azo)-5-((2-hydroxy-7-sulphonatonaphthyl)azo)naphthalene-2-sulphonate
| Molecular Formula | C36H22N7Na3O10S3 |
|---|---|
| Molecular Weight | 877.03 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 317.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 6 |
| Exact Mass | 877.0283 |
| Heavy Atoms | 59 |
| Complexity | 1750.0 |
Chemical Identifiers
| CAS Number | 68227-44-1 |
|---|---|
| SMILES | C1=CC(=CC2=C1C=CC(=C2N=NC3=C4C=CC(=CC4=C(C=C3)N=NC5=C6C=CC(=CC6=C(C=C5)N=NC7=CC=C(C=C7)N)S(=O)(=O)[O-])S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | HVSPKSXGBRIJIN-UHFFFAOYSA-K |
Product Overview
RefChem:88613 (CAS 68227-44-1), with molecular formula C36H22N7Na3O10S3 and molecular weight 877.03 g/mol. IUPAC: trisodium;8-[[4-[[4-[(4-aminophenyl)diazenyl]-6-sulfonatonaphthalen-1-yl]diazenyl]-6-sulfonatonaphthalen-1-yl]diazenyl]-7-hydroxynaphthalene-2-sulfonate.
Chemical Property Profile of RefChem:88613
Property Insights of RefChem:88613
The XLogP value of -0.6 indicates that RefChem:88613 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 317.0 Ų indicates high polarity, suggesting RefChem:88613 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:88613 has 2 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:88613?
The CAS number of RefChem:88613 is 68227-44-1.
What is the molecular formula of RefChem:88613?
The molecular formula of RefChem:88613 is C36H22N7Na3O10S3.
What is the molecular weight of RefChem:88613?
The molecular weight of RefChem:88613 is 877.03 g/mol.
Where can I buy RefChem:88613?
You can request a quote for RefChem:88613 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:88613?
Yes, KEHONG BIO provides custom synthesis services for RefChem:88613 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.