2,2'-((9,10-Dihydro-2,4-dinitro-9,10-dioxo-1,5-anthracenediyl)diimino)bis(2-oxoacetic) acid (CHEM064402)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-03 12:37:07 UTC | ||||||||
| Update Date | 2026-04-03 12:37:07 UTC | ||||||||
| Accession Number | CHEM064402 | ||||||||
| Identification | |||||||||
| Common Name | 2,2'-((9,10-Dihydro-2,4-dinitro-9,10-dioxo-1,5-anthracenediyl)diimino)bis(2-oxoacetic) acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C18H8N4O12 | ||||||||
| Average Molecular Mass | 472.278 g/mol | ||||||||
| Monoisotopic Mass | 472.014 g/mol | ||||||||
| CAS Registry Number | 116-72-3 | ||||||||
| IUPAC Name | 2-[[6,8-dinitro-5-(oxaloamino)-9,10-dioxoanthracen-1-yl]amino]-2-oxoacetic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | OC(=O)C(=O)NC1=CC=CC2=C1C(=O)C1=C(C2=O)C(NC(=O)C(O)=O)=C(C=C1[N+]([O-])=O)[N+]([O-])=O | ||||||||
| InChI Identifier | InChI=1S/C18H8N4O12/c23-13-5-2-1-3-6(19-15(25)17(27)28)9(5)14(24)10-7(21(31)32)4-8(22(33)34)12(11(10)13)20-16(26)18(29)30/h1-4H,(H,19,25)(H,20,26)(H,27,28)(H,29,30) | ||||||||
| InChI Key | BYLDLUPWIYFEHS-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 | ||||||||
