1,4-Bis(2-bromo-4-butyl-o-toluidino)anthraquinone (CHEM067878)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-03 20:24:20 UTC | ||||||||
| Update Date | 2026-04-03 20:24:20 UTC | ||||||||
| Accession Number | CHEM067878 | ||||||||
| Identification | |||||||||
| Common Name | 1,4-Bis(2-bromo-4-butyl-o-toluidino)anthraquinone | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C36H36Br2N2O2 | ||||||||
| Average Molecular Mass | 688.504 g/mol | ||||||||
| Monoisotopic Mass | 686.114 g/mol | ||||||||
| CAS Registry Number | 28198-04-1 | ||||||||
| IUPAC Name | 1,4-bis(2-bromo-4-butyl-6-methylanilino)anthracene-9,10-dione | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCCC1=CC(Br)=C(NC2=C3C(=O)C4=CC=CC=C4C(=O)C3=C(NC3=C(Br)C=C(CCCC)C=C3C)C=C2)C(C)=C1 | ||||||||
| InChI Identifier | InChI=1S/C36H36Br2N2O2/c1-5-7-11-23-17-21(3)33(27(37)19-23)39-29-15-16-30(40-34-22(4)18-24(12-8-6-2)20-28(34)38)32-31(29)35(41)25-13-9-10-14-26(25)36(32)42/h9-10,13-20,39-40H,5-8,11-12H2,1-4H3 | ||||||||
| InChI Key | LKKDBUMXNDIRMM-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 | |||||||||
| 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 | ||||||||
