Decyl 2-[1-[(z)-3-chloro-4-(2,4-dimethylphenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate (CHEM345847)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 14:46:21 UTC | ||||||||
| Update Date | 2026-08-31 14:46:21 UTC | ||||||||
| Accession Number | CHEM345847 | ||||||||
| Identification | |||||||||
| Common Name | Decyl 2-[1-[(z)-3-chloro-4-(2,4-dimethylphenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Decyl 2-[1-[(z)-3-chloro-4-(2,4-dimethylphenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate is a compound with the formula C29H47ClNO2+. It has an average molecular weight of 477.10 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C29H47ClNO2+ | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 476.330 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | Decyl 2-[1-[(z)-3-chloro-4-(2,4-dimethylphenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCCCCCCCCOC(=O)C[N+]1(CCCCC1)CC=C(CC2=C(C=C(C=C2)C)C)Cl | ||||||||
| InChI Identifier | InChI=1S/C29H47ClNO2/c1-4-5-6-7-8-9-10-14-21-33-29(32)24-31(18-12-11-13-19-31)20-17-28(30)23-27-16-15-25(2)22-26(27)3/h15-17,22H,4-14,18-21,23-24H2,1-3H3/q+1/b28-17- | ||||||||
| InChI Key | LENYDVRMXPESHC-QRQIAZFYSA-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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
