Basic information
- Standard SMILES
O=C1c2ccccc2C(=O)c2c1cccc2S(=O)(=O)[O-]- InChIKey
JAJIPIAHCFBEPI-UHFFFAOYSA-M- Molecular formula
- C14H7O5S-
- Average molar mass
- 287.27 g/mol
Names & identifiers
- Preferred name
- 9,10-Dioxoanthracene-1-sulfonate
- IUPAC
- 9,10-dioxoanthracene-1-sulfonate
Names & synonyms
Anthraquinone sulfonate9,10-dioxoanthracene-1-sulfonate9,10-dioxo-9,10-dihydro-1-anthracenesulfonateJAJIPIAHCFBEPI-UHFFFAOYSA-MAE-641/00783024
Database identifiers
- PubChem CID
- 3316477
- Nikkaji
- J2.410.613F
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 99.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- -1
- Complexity
- 519
Related reactions
1 records
Compound notes
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