2-[2-(4-chlorophenyl)-3-methoxy-4-oxochromen-6-yl]butanoic acid (CHEM200499)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-20 04:58:11 UTC | ||||||||
| Update Date | 2026-08-20 04:58:11 UTC | ||||||||
| Accession Number | CHEM200499 | ||||||||
| Identification | |||||||||
| Common Name | 2-[2-(4-chlorophenyl)-3-methoxy-4-oxochromen-6-yl]butanoic acid | ||||||||
| Class | Small Molecule | ||||||||
| Description | 2-[2-(4-chlorophenyl)-3-methoxy-4-oxochromen-6-yl]butanoic acid belongs to the o-methylated flavonoids, a subclass of flavonoids within the organic compounds. It is categorized under the superclass of phenylpropanoids and polyketides. The compound has the formula C20H17ClO5 and an average molecular weight of 372.80 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C20H17ClO5 | ||||||||
| Average Molecular Mass | 372.800 g/mol | ||||||||
| Monoisotopic Mass | 372.076 g/mol | ||||||||
| CAS Registry Number | Not Available | ||||||||
| IUPAC Name | 2-[2-(4-chlorophenyl)-3-methoxy-4-oxochromen-6-yl]butanoic acid | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C20H17ClO5/c1-3-14(20(23)24)12-6-9-16-15(10-12)17(22)19(25-2)18(26-16)11-4-7-13(21)8-5-11/h4-10,14H,3H2,1-2H3,(H,23,24) | ||||||||
| InChI Key | ZDKKXZIAGZMERT-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 | ||||||||
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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 | ||||||||
