3-(1,3-benzodioxol-5-yl)-6,7-dimethoxychromen-4-one (CHEM194801)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-19 23:07:52 UTC | ||||||||
| Update Date | 2026-08-19 23:07:52 UTC | ||||||||
| Accession Number | CHEM194801 | ||||||||
| Identification | |||||||||
| Common Name | 3-(1,3-benzodioxol-5-yl)-6,7-dimethoxychromen-4-one | ||||||||
| Class | Small Molecule | ||||||||
| Description | 3-(1,3-benzodioxol-5-yl)-6,7-dimethoxychromen-4-one belongs to the o-methylated isoflavonoids, a subclass of isoflavonoids within the organic compounds. It is classified within the superclass of phenylpropanoids and polyketides. This compound has the formula C18H14O6 and an average molecular weight of 326.30 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C18H14O6 | ||||||||
| Average Molecular Mass | 326.300 g/mol | ||||||||
| Monoisotopic Mass | 326.079 g/mol | ||||||||
| CAS Registry Number | 2746-85-2 | ||||||||
| IUPAC Name | 3-(1,3-benzodioxol-5-yl)-6,7-dimethoxychromen-4-one | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | Not Available | ||||||||
| InChI Identifier | InChI=1S/C18H14O6/c1-20-15-6-11-14(7-16(15)21-2)22-8-12(18(11)19)10-3-4-13-17(5-10)24-9-23-13/h3-8H,9H2,1-2H3 | ||||||||
| InChI Key | ABOSSEFROBUJKH-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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| 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 | |||||||||
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| Identifiers | Not Available | ||||||||
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| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
