C.I. Direct Blue 78, tetrasodium salt (CHEM106388)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-05 18:59:31 UTC | ||||||||
| Update Date | 2026-04-05 18:59:31 UTC | ||||||||
| Accession Number | CHEM106388 | ||||||||
| Identification | |||||||||
| Common Name | C.I. Direct Blue 78, tetrasodium salt | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C42H25N7Na4O13S4 | ||||||||
| Average Molecular Mass | 1055.900 g/mol | ||||||||
| Monoisotopic Mass | 1054.998 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | Tetrasodium 2-{[4-({4-[(7-anilino-2-hydroxy-3-sulfonatonaphthalen-1-yl)diazenyl]naphthalen-1-yl}diazenyl)-6-sulfonatonaphthalen-1-yl]diazenyl}benzene-1,4-disulfonate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | [Na+].[Na+].[Na+].[Na+].OC1=C(N=NC2=CC=C(N=NC3=CC=C(N=NC4=CC(=CC=C4S([O-])(=O)=O)S([O-])(=O)=O)C4=C3C=C(C=C4)S([O-])(=O)=O)C3=C2C=CC=C3)C2=CC(NC3=CC=CC=C3)=CC=C2C=C1S([O-])(=O)=O | ||||||||
| InChI Identifier | InChI=1S/C42H29N7O13S4.4Na/c50-42-40(66(60,61)62)20-24-10-11-26(43-25-6-2-1-3-7-25)21-32(24)41(42)49-47-35-16-15-34(29-8-4-5-9-30(29)35)44-46-37-18-17-36(31-14-12-27(22-33(31)37)63(51,52)53)45-48-38-23-28(64(54,55)56)13-19-39(38)65(57,58)59;;;;/h1-23,43,50H,(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62);;;;/q;4*+1/p-4 | ||||||||
| InChI Key | MIJVKZQQSWANSK-UHFFFAOYSA-J | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
