1-(4-Methylphenyl)-2-(pyrrolidin-1-yl)pentan-1-one (CHEM061351)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-03 04:36:51 UTC | ||||||||
| Update Date | 2026-08-28 20:34:41 UTC | ||||||||
| Accession Number | CHEM061351 | ||||||||
| Identification | |||||||||
| Common Name | 1-(4-Methylphenyl)-2-(pyrrolidin-1-yl)pentan-1-one | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C16H23N1O1 | ||||||||
| Average Molecular Mass | 245.366 g/mol | ||||||||
| Monoisotopic Mass | 245.178 g/mol | ||||||||
| CAS Registry Number | 3563-49-3 | ||||||||
| IUPAC Name | 1-(4-methylphenyl)-2-pyrrolidin-1-ylpentan-1-one | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CCCC(N1CCCC1)C(=O)C1=CC=C(C)C=C1 | ||||||||
| InChI Identifier | InChI=1S/C16H23NO/c1-3-6-15(17-11-4-5-12-17)16(18)14-9-7-13(2)8-10-14/h7-10,15H,3-6,11-12H2,1-2H3 | ||||||||
| InChI Key | SWUVZKWCOBGPTH-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 | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
