EINECS 276-679-4
TL;DR: EINECS 276-679-4 (CAS 72479-32-4) is a chemical compound with molecular formula C30H16CuN10Na2O14S2 and molecular weight 912.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper;disodium;3-nitro-5-[[5-[(4-nitrophenyl)diazenyl]-3-[[4-(4-nitro-2-sulfonatoanilino)phenyl]diazenyl]-2-oxidophenyl]diazenyl]-4-oxidobenzenesulfonate
Also Known As: EINECS 276-679-4, Cuprate(2-), (3-((2-(hydroxy-kappaO)-4-hydroxy-5-((4-nitrophenyl)azo)-3-((4-((4-nitro-2-sulfophenyl)amino)phenyl)azo)phenyl)azo-kappaN1)-4-(hydroxy-kappaO)-5-nitrobenzenesulfonato(4-))-, disodium, Cuprate(2-), (3-(2-(2-(hydroxy-kappaO)-4-hydroxy-5-(2-(4-nitrophenyl)diazenyl)-3-(2-(4-((4-nitro-2-sulfophenyl)amino)phenyl)diazenyl)phenyl)diazenyl-kappaN1)-4-(hydroxy-kappaO)-5-nitrobenzenesulfonato(4-))-, sodium (1:2), Cuprate(2-), [3-[[2-(hydroxy-.kappa.O)-4-hydroxy-5-[(4-nitrophenyl)azo]-3-[[4-[(4-nitro-2-sulfophenyl)amino]phenyl]azo]phenyl]azo-.kappa.N1]-4-(hydroxy-.kappa.O)-5-nitrobenzenesulfonato(4-)]-, disodium, Cuprate(2-), [3-[[2,4-dihydroxy-5-[(4-nitrophenyl)azo]-3-[[4-[(4-nitro-2-sulfophenyl)amino]phenyl]azo]phenyl]azo]-4-hydroxy-5-nitrobenzenesulfonato(4-)]-, disodium
| Molecular Formula | C30H16CuN10Na2O14S2 |
|---|---|
| Molecular Weight | 912.94 g/mol |
| LogP | 0.3619 |
| Topological Polar Surface Area | 376.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 13 |
| Exact Mass | 912.93805 |
| Heavy Atoms | 59 |
| Complexity | 2745.5002 |
Chemical Identifiers
| CAS Number | 72479-32-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)[O-])N=NC3=C(C(=CC(=C3)N=NC4=CC=C(C=C4)[N+](=O)[O-])N=NC5=C(C(=CC(=C5)S(=O)(=O)[O-])[N+](=O)[O-])[O-])[O-].[Na+].[Na+].[Cu+2] |
Product Overview
EINECS 276-679-4 (CAS 72479-32-4), with molecular formula C30H16CuN10Na2O14S2 and molecular weight 912.94 g/mol. IUPAC: copper;disodium;3-nitro-5-[[5-[(4-nitrophenyl)diazenyl]-3-[[4-(4-nitro-2-sulfonatoanilino)phenyl]diazenyl]-2-oxidophenyl]diazenyl]-4-oxidobenzenesulfonate.
Chemical Property Profile of EINECS 276-679-4
Property Insights of EINECS 276-679-4
The XLogP value of 0.3619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 276-679-4. The TPSA of 376.13 Ų indicates high polarity, suggesting EINECS 276-679-4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 276-679-4 has 1 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 276-679-4?
The CAS number of EINECS 276-679-4 is 72479-32-4.
What is the molecular formula of EINECS 276-679-4?
The molecular formula of EINECS 276-679-4 is C30H16CuN10Na2O14S2.
What is the molecular weight of EINECS 276-679-4?
The molecular weight of EINECS 276-679-4 is 912.94 g/mol.
Where can I buy EINECS 276-679-4?
You can request a quote for EINECS 276-679-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 276-679-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 276-679-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.