Basic information
- CAS
87722-82-5- Standard SMILES
CC1=C(O)c2cc3c(cc2C(=O)C1=O)OCO3- InChIKey
XQBBSPWGMWELNU-UHFFFAOYSA-N- Molecular formula
- C12H8O5
- Average molar mass
- 232.19 g/mol
- Monoisotopic mass
- 232.03717335
Names & identifiers
- Preferred name
- 8-Hydroxy-7-methylbenzo[f][1,3]benzodioxole-5,6-dione
- IUPAC
- 8-hydroxy-7-methylbenzo[f][1,3]benzodioxole-5,6-dione
Names & synonyms
87722-82-58-hydroxy-7-methylbenzo[f][1,3]benzodioxole-5,6-dioneNSC372394DTXSID30321250NSC-3723948-Hydroxy-7-methyl-2H-naphtho[2,3-d][1,3]dioxole-5,6-dione
Database identifiers
- CAS
87722-82-5- PubChem CID
- 341024
- DTXSID
DTXSID30321250
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 425
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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