HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 175263Generated: November 4, 2026
Cuprate(4-), [5-[[4-chloro-6-[(2-methyl-4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-(hydroxy-kappaO)-3-[2-[2-(hydroxy-kappaO)-4-sulfo-1-naphthalenyl]diazenyl-kappaN1]-2,7-naphthalenedisulfonato(6-)]-, sodium (1:4)
https://huagongshe.com/en/chemical/175263
Identifiers & Physical Properties
| CAS No. | 72906-65-1 |
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| Molecular formula | C30H16ClCuN7Na4O14S4 |
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| Average molar mass | 1,017.7 g/mol |
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| Monoisotopic mass | 1,015.821335 g/mol |
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| SMILES | Cc1cc(S(=O)(=O)[O-])ccc1Nc1nc(Cl)nc(Nc2cc(S(=O)(=O)[O-])cc3cc(S(=O)(=O)[O-])c(N=Nc4c([O-])cc(S(=O)(=O)[O-])c5ccccc45)c([O-])c23)n1.[Cu+2].[Na+].[Na+].[Na+].[Na+] |
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| InChIKey | XVWIMSXRAXHTDI-UHFFFAOYSA-H |
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| PubChem CID | 175263 |
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| EC No. | 277-011-4 |
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Chemical & Physical Properties
| Topological polar surface area | 396 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 21 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 61 |
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| Formal charge | 0 |
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| Complexity | 1,820 |
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![Cuprate(4-), [5-[[4-chloro-6-[(2-methyl-4-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-(hydroxy-kappaO)-3-[2-[2-(hydroxy-kappaO)-4-sulfo-1-naphthalenyl]diazenyl-kappaN1]-2,7-naphthalenedisulfonato(6-)]-, sodium (1:4) molecular structure](/img/chemical/175263.png)