4,4'-Carbonimidoylbis[N,N-dimethylanilinium] sulphate (CHEM124442)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 12:27:40 UTC | ||||||||
| Update Date | 2026-08-29 02:22:20 UTC | ||||||||
| Accession Number | CHEM124442 | ||||||||
| Identification | |||||||||
| Common Name | 4,4'-Carbonimidoylbis[N,N-dimethylanilinium] sulphate | ||||||||
| Class | Small Molecule | ||||||||
| Description | 4,4'-Carbonimidoylbis[N,N-dimethylanilinium] sulphate belongs to the diphenylmethanes, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C17H21N3O8S2 and an average molecular weight of 459.50 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C17H21N3O8S2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 459.077 g/mol | ||||||||
| CAS Registry Number | 52497-46-8 | ||||||||
| IUPAC Name | [6-[3,4-dimethyl-2-(sulfooxyamino)benzenecarboximidoyl]-2,3-dimethylanilino] hydrogen sulfate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1=C(C(=C(C=C1)C(=N)C2=C(C(=C(C=C2)C)C)NOS(=O)(=O)O)NOS(=O)(=O)O)C | ||||||||
| InChI Identifier | InChI=1S/C17H21N3O8S2/c1-9-5-7-13(16(11(9)3)19-27-29(21,22)23)15(18)14-8-6-10(2)12(4)17(14)20-28-30(24,25)26/h5-8,18-20H,1-4H3,(H,21,22,23)(H,24,25,26) | ||||||||
| InChI Key | NLMWARNXMUCDRB-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 |
| ||||||||
| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
| ||||||||
| 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 | ||||||||
