1-(3,4-dihydroxy-5-nitrophenyl)pentan-1-one (CHEM156479)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-18 09:51:04 UTC | ||||||||
| Update Date | 2026-08-18 09:51:04 UTC | ||||||||
| Accession Number | CHEM156479 | ||||||||
| Identification | |||||||||
| Common Name | 1-(3,4-dihydroxy-5-nitrophenyl)pentan-1-one | ||||||||
| Class | Small Molecule | ||||||||
| Description | 1-(3,4-dihydroxy-5-nitrophenyl)pentan-1-one belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. It has the formula C11H13NO5 and an average molecular weight of 239.22 g/mol. This substance is further classified under the superclass of organic oxygen compounds and the class of organooxygen compounds. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C11H13NO5 | ||||||||
| Average Molecular Mass | 239.220 g/mol | ||||||||
| Monoisotopic Mass | 239.079 g/mol | ||||||||
| CAS Registry Number | 125628-93-5 | ||||||||
| IUPAC Name | 1-(3,4-dihydroxy-5-nitrophenyl)pentan-1-one | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C11H13NO5/c1-2-3-4-9(13)7-5-8(12(16)17)11(15)10(14)6-7/h5-6,14-15H,2-4H2,1H3 | ||||||||
| InChI Key | ZPJRQVFLMJNWEB-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 | ||||||||
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| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
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| 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 | ||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
