6-Hydroxybenzo[f][1,3]benzodioxole-4,9-dione
Basic information
- CAS
86319-84-8- Standard SMILES
O=C1C2=C(OCO2)C(=O)c2cc(O)ccc21- InChIKey
LSIPLBZFCFHDPE-UHFFFAOYSA-N- Molecular formula
- C11H6O5
- Average molar mass
- 218.16 g/mol
- Monoisotopic mass
- 218.02152329
Names & identifiers
- Preferred name
- 6-Hydroxybenzo[f][1,3]benzodioxole-4,9-dione
- IUPAC
- 6-hydroxybenzo[f][1,3]benzodioxole-4,9-dione
Names & synonyms
6-hydroxybenzo[f][1,3]benzodioxole-4,9-dioneNSC37239786319-84-8SCHEMBL10522287DTXSID90321251NSC-372397Naphtho[2,3-d]-1,3-dioxole-4,9-dione, 6-hydroxy-6-Hydroxy-2H-naphtho[2,3-d][1,3]dioxole-4,9-dione
Database identifiers
- CAS
86319-84-8- PubChem CID
- 341027
- DTXSID
DTXSID90321251
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 397
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Compound notes
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