1-[(z)-3-chloro-4-(4-methylphenyl)but-2-enyl]-1-[(e)-4-(4-methylphenyl)but-2-enyl]piperidin-1-ium (CHEM342890)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 10:36:17 UTC | ||||||||
| Update Date | 2026-08-31 10:36:17 UTC | ||||||||
| Accession Number | CHEM342890 | ||||||||
| Identification | |||||||||
| Common Name | 1-[(z)-3-chloro-4-(4-methylphenyl)but-2-enyl]-1-[(e)-4-(4-methylphenyl)but-2-enyl]piperidin-1-ium | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C27H35ClN+ | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 408.246 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | Not Available | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1=CC=C(C=C1)CC=CC[N+]2(CCCCC2)CC=C(CC3=CC=C(C=C3)C)Cl | ||||||||
| InChI Identifier | InChI=1S/C27H35ClN/c1-23-9-13-25(14-10-23)8-4-7-20-29(18-5-3-6-19-29)21-17-27(28)22-26-15-11-24(2)12-16-26/h4,7,9-17H,3,5-6,8,18-22H2,1-2H3/q+1/b7-4+,27-17- | ||||||||
| InChI Key | YXAGCYUMXIRDSS-SCFFSWJHSA-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 | |||||||||
| 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 | ||||||||
