Basic information
- Standard SMILES
CC(C(=O)O)c1cccc(Oc2ccccc2)c1O.O=S(=O)([O-])[O-].[K+].[K+]- InChIKey
RMPUVKNBPMAXEO-UHFFFAOYSA-L- Molecular formula
- C15H14K2O8S
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 431.9683515
Names & identifiers
- Preferred name
- 2-Hydroxy-3-phenoxy-hydratropic acid sulphate dipotassium salt
- IUPAC
- dipotassium;2-(2-hydroxy-3-phenoxyphenyl)propanoic acid;sulfate
Names & synonyms
SCHEMBL11110845RMPUVKNBPMAXEO-UHFFFAOYSA-L2-hydroxy-3-phenoxy-hydratropic acid sulphate dipotassium salt
Database identifiers
- PubChem CID
- 70514935
Properties
Computed structural properties
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 361
Related reactions
3 records
Compound notes
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