RefChem:72887
TL;DR: RefChem:72887 (CAS 68214-56-2) is a chemical compound with molecular formula C25H21N3Na2O9S3 and molecular weight 649.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;8-[[3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl]diazenyl]-7-hydroxynaphthalene-1,3-disulfonate
Also Known As: 1,3-Naphthalenedisulfonic acid, 8-((3-((ethylphenylamino)sulfonyl)-4-methylphenyl)azo)-7-hydroxy-, disodium salt, 1,3-Naphthalenedisulfonic acid, 8-(2-(3-((ethylphenylamino)sulfonyl)-4-methylphenyl)diazenyl)-7-hydroxy-, sodium salt (1:2), 1,3-Naphthalenedisulfonic acid, 8-[[3-[(ethylphenylamino)sulfonyl]-4-methylphenyl]azo]-7-hydroxy-, disodium salt, 1,3-Naphthalenedisulfonic acid, 8-[2-[3-[(ethylphenylamino)sulfonyl]-4-methylphenyl]diazenyl]-7-hydroxy-, sodium salt (1:2), Disodium 8-((3-((ethylphenylamino)sulphonyl)-4-methylphenyl)azo)-7-hydroxynaphthalene-1,3-disulphonate
| Molecular Formula | C25H21N3Na2O9S3 |
|---|---|
| Molecular Weight | 649.02 g/mol |
| LogP | -1.69938 |
| Topological Polar Surface Area | 222.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 649.02356 |
| Heavy Atoms | 42 |
| Complexity | 1190.0 |
Chemical Identifiers
| CAS Number | 68214-56-2 |
|---|---|
| SMILES | CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)N=NC3=C(C=CC4=CC(=CC(=C43)S(=O)(=O)[O-])S(=O)(=O)[O-])O)C.[Na+].[Na+] |
| InChIKey | PAADLUNUXAUQFN-UHFFFAOYSA-L |
Product Overview
RefChem:72887 (CAS 68214-56-2), with molecular formula C25H21N3Na2O9S3 and molecular weight 649.02 g/mol. IUPAC: disodium;8-[[3-[ethyl(phenyl)sulfamoyl]-4-methylphenyl]diazenyl]-7-hydroxynaphthalene-1,3-disulfonate.
Chemical Property Profile of RefChem:72887
Property Insights of RefChem:72887
The XLogP value of -1.69938 indicates that RefChem:72887 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 222.0 Ų indicates high polarity, suggesting RefChem:72887 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:72887 has 1 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:72887?
The CAS number of RefChem:72887 is 68214-56-2.
What is the molecular formula of RefChem:72887?
The molecular formula of RefChem:72887 is C25H21N3Na2O9S3.
What is the molecular weight of RefChem:72887?
The molecular weight of RefChem:72887 is 649.02 g/mol.
Where can I buy RefChem:72887?
You can request a quote for RefChem:72887 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:72887?
Yes, KEHONG BIO provides custom synthesis services for RefChem:72887 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.