RefChem:446418
TL;DR: RefChem:446418 (CAS 52469-76-8) is a chemical compound with molecular formula C32H21N8Na3O11S3 and molecular weight 858.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;5-amino-3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfonatonaphthalen-2-yl)diazenyl]phenyl]diazenyl]phenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonate
Also Known As: 2,7-Naphthalenedisulfonic acid, 5-amino-3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo]phenyl]azo]phenyl]azo]-4-hydroxy-, trisodium salt, 2,7-Naphthalenedisulfonic acid, 5-amino-3-((4-((4-((6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo)phenyl)azo)phenyl)azo)-4-hydroxy-, trisodium salt, 2,7-Naphthalenedisulfonic acid, 5-amino-3-(2-(4-(2-(4-(2-(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl)phenyl)diazenyl)phenyl)diazenyl)-4-hydroxy-, sodium salt (1:3), 2,7-Naphthalenedisulfonic acid, 5-amino-3-((4-((4-((6(or 7)-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo)phenyl)azo)phenyl)azo)-4-hydroxy-, trisodium salt, 2,7-Naphthalenedisulfonic acid, 5-amino-3-[2-[4-[2-[4-[2-(6-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]phenyl]diazenyl]phenyl]diazenyl]-4-hydroxy-, sodium salt (1:3)
| Molecular Formula | C32H21N8Na3O11S3 |
|---|---|
| Molecular Weight | 858.02 g/mol |
| LogP | -2.46 |
| Topological Polar Surface Area | 363.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 6 |
| Exact Mass | 858.0185 |
| Heavy Atoms | 57 |
| Complexity | 1680.0 |
Chemical Identifiers
| CAS Number | 52469-76-8 |
|---|---|
| SMILES | C1=CC(=CC=C1N=NC2=CC=C(C=C2)N=NC3=C(C=C4C=C(C=CC4=C3O)N)S(=O)(=O)[O-])N=NC5=C(C6=C(C=C(C=C6C=C5S(=O)(=O)[O-])S(=O)(=O)[O-])N)O.[Na+].[Na+].[Na+] |
| InChIKey | YBDCRIBGAOBGMN-UHFFFAOYSA-K |
Product Overview
RefChem:446418 (CAS 52469-76-8), with molecular formula C32H21N8Na3O11S3 and molecular weight 858.02 g/mol. IUPAC: trisodium;5-amino-3-[[4-[[4-[(6-amino-1-hydroxy-3-sulfonatonaphthalen-2-yl)diazenyl]phenyl]diazenyl]phenyl]diazenyl]-4-hydroxynaphthalene-2,7-disulfonate.
Chemical Property Profile of RefChem:446418
Property Insights of RefChem:446418
The XLogP value of -2.46 indicates that RefChem:446418 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 363.0 Ų indicates high polarity, suggesting RefChem:446418 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:446418 has 4 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:446418?
The CAS number of RefChem:446418 is 52469-76-8.
What is the molecular formula of RefChem:446418?
The molecular formula of RefChem:446418 is C32H21N8Na3O11S3.
What is the molecular weight of RefChem:446418?
The molecular weight of RefChem:446418 is 858.02 g/mol.
Where can I buy RefChem:446418?
You can request a quote for RefChem:446418 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:446418?
Yes, KEHONG BIO provides custom synthesis services for RefChem:446418 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.