Copper dye
TL;DR: Copper dye (CAS 52953-36-3) is a chemical compound with molecular formula C38H26CuN10Na4O17S4 and molecular weight 1176.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper;tetrasodium;7-[[4-(2-hydroxyethylamino)-6-[[(6E)-6-[(2-oxido-5-sulfonatophenyl)hydrazinylidene]-5-oxo-7-sulfonatonaphthalen-2-yl]amino]-1,3,5-triazin-2-yl]amino]-3-[(4-methoxy-2-sulfonatophenyl)diazenyl]-4-oxidonaphthalene-2-sulfonate
Also Known As: Copper dye, EINECS 258-271-8, Cuprate(4-), [4-hydroxy-7-[[4-[(2-hydroxyethyl)amino]-6-[[5-(hydroxy-.kappa.O)-6-[[2-(hydroxy-.kappa.O)-5-sulfophenyl]azo-.kappa.N1]-7-sulfo-2-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]-3-[(4-methoxy-2-sulfophenyl)azo]-2-naphthalenesulfonato(6-)]-, tetrasodium, Cuprate(4-), (4-hydroxy-7-((4-((2-hydroxyethyl)amino)-6-((5-(hydroxy-kappaO)-6-((2-(hydroxy-kappaO)-5-sulfophenyl)azo-kappaN1)-7-sulfo-2-naphthalenyl)amino)-1,3,5-triazin-2-yl)amino)-3-((4-methoxy-2-sulfophenyl)azo)-2-naphthalenesulfonato(6-))-, tetrasodium, Cuprate(4-), [4-hydroxy-7-[[4-[(2-hydroxyethyl)amino]-6-[[5-hydroxy-6-[(2-hydroxy-5-sulfophenyl)azo]-7-sulfo-2-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]-3-[(4-methoxy-2-sulfophenyl)azo]-2-naphthalenesulfonato(6-)]-, tetrasodium
| Molecular Formula | C38H26CuN10Na4O17S4 |
|---|---|
| Molecular Weight | 1176.92 g/mol |
| LogP | -10.2363 |
| Topological Polar Surface Area | 445.32 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 27 |
| Rotatable Bonds | 16 |
| Exact Mass | 1176.9247 |
| Heavy Atoms | 74 |
| Complexity | 3714.8345 |
Chemical Identifiers
| CAS Number | 52953-36-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)N=NC2=C(C=C3C=C(C=CC3=C2[O-])NC4=NC(=NC(=N4)NCCO)NC5=CC6=C(C=C5)C(=O)/C(=N\NC7=C(C=CC(=C7)S(=O)(=O)[O-])[O-])/C(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Cu+2] |
Product Overview
Copper dye (CAS 52953-36-3), with molecular formula C38H26CuN10Na4O17S4 and molecular weight 1176.92 g/mol. IUPAC: copper;tetrasodium;7-[[4-(2-hydroxyethylamino)-6-[[(6E)-6-[(2-oxido-5-sulfonatophenyl)hydrazinylidene]-5-oxo-7-sulfonatonaphthalen-2-yl]amino]-1,3,5-triazin-2-yl]amino]-3-[(4-methoxy-2-sulfonatophenyl)diazenyl]-4-oxidonaphthalene-2-sulfonate.
Chemical Property Profile of Copper dye
Property Insights of Copper dye
The XLogP value of -10.2363 indicates that Copper dye is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 445.32 Ų indicates high polarity, suggesting Copper dye may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Copper dye has 5 hydrogen bond donor(s) and 27 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Copper dye?
The CAS number of Copper dye is 52953-36-3.
What is the molecular formula of Copper dye?
The molecular formula of Copper dye is C38H26CuN10Na4O17S4.
What is the molecular weight of Copper dye?
The molecular weight of Copper dye is 1176.92 g/mol.
Where can I buy Copper dye?
You can request a quote for Copper dye directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Copper dye?
Yes, KEHONG BIO provides custom synthesis services for Copper dye and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.