2-[[3-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)methylamino]-1-hydroxy-3-sulfonaphthalen-2-yl]diazenyl]-4-hydroxyphenyl]methyldiazenyl]benzene-1,4-disulfonic acid (CHEM341741)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 08:51:43 UTC | ||||||||
| Update Date | 2026-08-31 08:51:43 UTC | ||||||||
| Accession Number | CHEM341741 | ||||||||
| Identification | |||||||||
| Common Name | 2-[[3-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)methylamino]-1-hydroxy-3-sulfonaphthalen-2-yl]diazenyl]-4-hydroxyphenyl]methyldiazenyl]benzene-1,4-disulfonic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 2-[[3-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)methylamino]-1-hydroxy-3-sulfonaphthalen-2-yl]diazenyl]-4-hydroxyphenyl]methyldiazenyl]benzene-1,4-disulfonic acid has the chemical formula C27H20Cl2N8O11S3. With an average molecular weight of 799.60 g/mol, 2-[[3-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)methylamino]-1-hydroxy-3-sulfonaphthalen-2-yl]diazenyl]-4-hydroxyphenyl]methyldiazenyl]benzene-1,4-disulfonic acid is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C27H20Cl2N8O11S3 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 797.979 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 2-[[3-[[6-[(4,6-dichloro-1,3,5-triazin-2-yl)methylamino]-1-hydroxy-3-sulfonaphthalen-2-yl]diazenyl]-4-hydroxyphenyl]methyldiazenyl]benzene-1,4-disulfonic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | C1=CC(=C(C=C1CN=NC2=C(C=CC(=C2)S(=O)(=O)O)S(=O)(=O)O)N=NC3=C(C=C4C=C(C=CC4=C3O)NCC5=NC(=NC(=N5)Cl)Cl)S(=O)(=O)O)O | ||||||||
| InChI Identifier | InChI=1S/C27H20Cl2N8O11S3/c28-26-32-23(33-27(29)34-26)12-30-15-2-4-17-14(8-15)9-22(51(46,47)48)24(25(17)39)37-36-18-7-13(1-5-20(18)38)11-31-35-19-10-16(49(40,41)42)3-6-21(19)50(43,44)45/h1-10,30,38-39H,11-12H2,(H,40,41,42)(H,43,44,45)(H,46,47,48) | ||||||||
| InChI Key | VYKHFVYAQAHUFU-UHFFFAOYSA-N | ||||||||
| 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 | |||||||||
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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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
