3-(1,3-Benzodioxol-5-ylmethylidene)oxolane-2,4-dione
3-(1,3-benzodioxol-5-ylmethylidene)oxolane-2,4-dione
Also Known As: 3-(1,3-benzodioxol-5-ylmethylidene)oxolane-2,4-dione|3-(benzo[1,3]dioxol-5-ylmethylidene)oxolane-2,4-dione|(3E)-3-(1,3-benzodioxol-5-ylmethylene)-2,4(3H,5H)-furandione
CAS: 87191-93-3
| Molecular Formula | C12H8O5 |
|---|---|
| Molecular Weight | 232.03717 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.03717 |
| Monoisotopic Mass | 232.03717 |
| Heavy Atoms | 17 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 87191-93-3 |
|---|---|
| SMILES | C1C(=O)C(=CC2=CC3=C(C=C2)OCO3)C(=O)O1 |
| InChIKey | WMDLMQGCPDNRAX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (24 patents)
Pharmaceutical Intermediates (9 patents)
Product Overview
3-(1,3-Benzodioxol-5-ylmethylidene)oxolane-2,4-dione (CAS 87191-93-3), with molecular formula C12H8O5 and molecular weight 232.03717 g/mol. IUPAC: 3-(1,3-benzodioxol-5-ylmethylidene)oxolane-2,4-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
3-(1,3-Benzodioxol-5-ylmethylidene)oxolane-2,4-dione is a custom synthesis product. We offer services from milligram to kilogram scale.
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