[4-[[4-(dimethylamino)phenyl]-[2-ethoxy-4-(4-methyl-2-sulfoanilino)-5-sulfophenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium (CHEM348117)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 18:26:45 UTC | ||||||||
| Update Date | 2026-08-31 18:26:45 UTC | ||||||||
| Accession Number | CHEM348117 | ||||||||
| Identification | |||||||||
| Common Name | [4-[[4-(dimethylamino)phenyl]-[2-ethoxy-4-(4-methyl-2-sulfoanilino)-5-sulfophenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium | ||||||||
| Class | Small Molecule | ||||||||
| Description | [4-[[4-(dimethylamino)phenyl]-[2-ethoxy-4-(4-methyl-2-sulfoanilino)-5-sulfophenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium is a compound with the formula C32H36N3O7S2+. With an average molecular weight of 638.80 g/mol, [4-[[4-(dimethylamino)phenyl]-[2-ethoxy-4-(4-methyl-2-sulfoanilino)-5-sulfophenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium is a heavy molecule. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C32H36N3O7S2+ | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 638.199 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | [4-[[4-(dimethylamino)phenyl]-[2-ethoxy-4-(4-methyl-2-sulfoanilino)-5-sulfophenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCOC1=CC(=C(C=C1C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C)S(=O)(=O)O)NC4=C(C=C(C=C4)C)S(=O)(=O)O | ||||||||
| InChI Identifier | InChI=1S/C32H35N3O7S2/c1-7-42-29-20-28(33-27-17-8-21(2)18-30(27)43(36,37)38)31(44(39,40)41)19-26(29)32(22-9-13-24(14-10-22)34(3)4)23-11-15-25(16-12-23)35(5)6/h8-20H,7H2,1-6H3,(H2,36,37,38,39,40,41)/p+1 | ||||||||
| InChI Key | SZRWRYMAKQVOMZ-UHFFFAOYSA-O | ||||||||
| 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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
