octyl 2-[1-[(E)-4-(2-chlorophenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate,chloride structure
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Common Name | octyl 2-[1-[(E)-4-(2-chlorophenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate,chloride | ||
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| CAS Number | 52171-89-8 | Molecular Weight | 456.48900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C25H39Cl2NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | octyl 2-[1-[(E)-4-(2-chlorophenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate,chloride |
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| Synonym | More Synonyms |
| Molecular Formula | C25H39Cl2NO2 |
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| Molecular Weight | 456.48900 |
| Exact Mass | 455.23600 |
| PSA | 26.30000 |
| LogP | 3.30590 |
| InChIKey | VLLLVHYXPDHYCX-RSGUCCNWSA-M |
| SMILES | CCCCCCCCOC(=O)C[N+]1(CC=CCc2ccccc2Cl)CCCCC1.[Cl-] |
| 1-(4-(o-Chlorophenyl)-2-butenyl)-1-(octyloxycarbonylmethyl)piperidinium chloride |
| octyl 2-[1-[(E)-4-(2-chlorophenyl)but-2-enyl]piperidin-1-ium-1-yl]acetate chloride |
| Piperidinium,1-(carboxymethyl)-1-(4-(o-chlorophenyl)-2-butenyl)-,chloride,octyl ester |