1,3-Benzodioxole-5,6-dicarboxylic acid
1,3-benzodioxole-5,6-dicarboxylic acid
Also Known As: Hydrastic acid|1,3-Benzodioxole-5,6-dicarboxylic acid|4-methylenedioxyphthalic acid|2H-1,3-benzodioxole-5,6-dicarboxylic acid|1,3-benzodioxole-5,6-dicarbonsäure|1,3-Benzodioxole-5,6-dicarboxylic acid #
CAS: 490-26-6
| Molecular Formula | C9H6O6 |
|---|---|
| Molecular Weight | 210.01643 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.01643 |
| Monoisotopic Mass | 210.01643 |
| Heavy Atoms | 15 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 490-26-6 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C(=C2)C(=O)O)C(=O)O |
| InChIKey | UMEVZMYDJGBHMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (1 patents)
Dyes & Pigments (1 patents)
Heterocyclic Building Blocks (20 patents)
Organic Building Blocks (13 patents)
Pharmaceutical Intermediates (8 patents)
Textile Chemicals (1 patents)
Product Overview
1,3-Benzodioxole-5,6-dicarboxylic acid (CAS 490-26-6), with molecular formula C9H6O6 and molecular weight 210.01643 g/mol. IUPAC: 1,3-benzodioxole-5,6-dicarboxylic acid.
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.
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