Bis[2-[[4-(2,2-dicyanovinyl)-3-methylphenyl]ethylamino]ethyl] adipate (CHEM083078)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-04 22:06:17 UTC | ||||||||
| Update Date | 2026-04-04 22:06:17 UTC | ||||||||
| Accession Number | CHEM083078 | ||||||||
| Identification | |||||||||
| Common Name | Bis[2-[[4-(2,2-dicyanovinyl)-3-methylphenyl]ethylamino]ethyl] adipate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Bis[2-[[4-(2,2-dicyanovinyl)-3-methylphenyl]ethylamino]ethyl] adipate belongs to the toluenes, a subclass of benzene and substituted derivatives within the organic compounds. It has the chemical formula C36H40N6O4. With an average molecular weight of 620.75 g/mol, Bis[2-[[4-(2,2-dicyanovinyl)-3-methylphenyl]ethylamino]ethyl] adipate is a heavy molecule. It is further classified as a benzenoid. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C36H40N6O4 | ||||||||
| Average Molecular Mass | 620.754 g/mol | ||||||||
| Monoisotopic Mass | 620.311 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | Not Available | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCN(CCOC(=O)CCCCOC(=O)CCN(CC)C1=CC(C)=C(C=C(C#N)C#N)C=C1)C1=CC(C)=C(C=C(C#N)C#N)C=C1 | ||||||||
| InChI Identifier | InChI=1/C36H40N6O4/c1-5-41(33-13-11-31(27(3)19-33)21-29(23-37)24-38)15-17-45-35(43)9-7-8-10-36(44)46-18-16-42(6-2)34-14-12-32(28(4)20-34)22-30(25-39)26-40/h11-14,19-22H,5-10,15-18H2,1-4H3 | ||||||||
| InChI Key | PDOOQWTZCPNMLF-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 | ||||||||
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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 | ||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
