Basic information
- CAS
96143-97-4- Standard SMILES
Nc1ccc(OS(=O)(=O)[O-])c(C(=O)[O-])c1.[K+].[K+]- InChIKey
CRGMKARRDAPJKR-UHFFFAOYSA-L- Molecular formula
- C7H5K2NO6S
- Average molar mass
- 309.38 g/mol
- Monoisotopic mass
- 308.911171
Names & identifiers
- Preferred name
- Benzoic acid, 5-amino-2-(sulfooxy)-, dipotassium salt
- IUPAC
- dipotassium;5-amino-2-sulfonatooxybenzoate
Names & synonyms
Benzoic acid, 5-amino-2-(sulfooxy)-, dipotassium salt96143-97-45-ASA potassium salt5-Aminosalicylic acid-O-sulfate potassium saltSCHEMBL10492759DTXSID20242142DIPOTASSIUM 5-AMINO-2-(SULFONATOOXY)BENZOATE
Database identifiers
- CAS
96143-97-4- PubChem CID
- 175671
- DTXSID
DTXSID20242142
Properties
Computed structural properties
- Topological polar surface area
- 141 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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