TL;DR: EINECS 233-309-6 (CAS 10114-24-6) is a chemical compound with molecular formula C38H25N6Na3O13S3 and molecular weight 938.0335 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trisodium;4-hydroxy-7-[[5-hydroxy-6-[(2-methoxyphenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]carbamoylamino]-3-[(6-sulfonatonaphthalen-2-yl)diazenyl]naphthalene-2-sulfonate
Also Known As: Trisodium 7-((((6-((o-anisyl)azo)-5-hydroxy-7-sulphonato-2-naphthyl)amino)carbonyl)amino)-4-hydroxy-3-((6-sulphonato-2-naphthyl)azo)naphthalene-2-sulphonate, 2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-((2-methoxyphenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-((6-sulfo-2-naphthalenyl)azo)-, trisodium salt, 2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-(2-(2-methoxyphenyl)diazenyl)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-(2-(6-sulfo-2-naphthalenyl)diazenyl)-, sodium salt (1:3), Trisodium;4-hydroxy-7-[[5-hydroxy-6-[(2-methoxyphenyl)diazenyl]-7-sulfonatonaphthalen-2-yl]carbamoylamino]-3-[(6-sulfonatonaphthalen-2-yl)diazenyl]naphthalene-2-sulfonate, 2-Naphthalenesulfonic acid, 4-hydroxy-7-((((5-hydroxy-6-((2-methoxyphenyl)azo)-7-sulfo-2-naphthalenyl)amino)carbonyl)amino)-3-((6-sulfo-2-naphthalenyl)azo)-, tetrasodium salt
| Molecular Formula | C38H25N6Na3O13S3 |
| Molecular Weight | 938.0335 g/mol |
| XLogP | -1.23 |
| Topological Polar Surface Area (TPSA) | 337.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 7 |
| Exact Mass | 938.0335 Da |
| Heavy Atoms | 63 |
| Complexity | 1870.0 |
| SMILES | COC1=CC=CC=C1N=NC2=C(C=C3C=C(C=CC3=C2O)NC(=O)NC4=CC5=CC(=C(C(=C5C=C4)O)N=NC6=CC7=C(C=C6)C=C(C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] |
| InChIKey | WLJRMSBYKYEWDC-UHFFFAOYSA-K |
The XLogP value of -1.23 indicates that EINECS 233-309-6 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 337.0 Ų indicates high polarity, suggesting EINECS 233-309-6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 233-309-6 has 4 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of EINECS 233-309-6 is 10114-24-6.
The molecular formula of EINECS 233-309-6 is C38H25N6Na3O13S3.
The molecular weight of EINECS 233-309-6 is 938.0335 g/mol.
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