Isopropyl 4-(4-(N,N-bis(2-hydroxyethyl)amino)phenyl)butyrate (CHEM076785)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-04-04 16:40:14 UTC | ||||||||
| Update Date | 2026-04-04 16:40:14 UTC | ||||||||
| Accession Number | CHEM076785 | ||||||||
| Identification | |||||||||
| Common Name | Isopropyl 4-(4-(N,N-bis(2-hydroxyethyl)amino)phenyl)butyrate | ||||||||
| Class | Small Molecule | ||||||||
| Description | Not Available | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C17H27N1O4 | ||||||||
| Average Molecular Mass | 309.406 g/mol | ||||||||
| Monoisotopic Mass | 309.194 g/mol | ||||||||
| CAS Registry Number | 94086-78-9 | ||||||||
| IUPAC Name | propan-2-yl 4-[4-[bis(2-hydroxyethyl)amino]phenyl]butanoate | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(C)OC(=O)CCCC1=CC=C(C=C1)N(CCO)CCO | ||||||||
| InChI Identifier | InChI=1S/C17H27NO4/c1-14(2)22-17(21)5-3-4-15-6-8-16(9-7-15)18(10-12-19)11-13-20/h6-9,14,19-20H,3-5,10-13H2,1-2H3 | ||||||||
| InChI Key | QDRCRYJKFQEJNJ-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 | ||||||||
