1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)
Basic information
- CAS
68226-90-4- Standard SMILES
O=C(c1ccc(C(=O)[O-])c(C(=O)[O-])c1)c1ccc(C(=O)O)c(C(=O)[O-])c1.[K+].[K+].[K+]- InChIKey
COHGWCHNMXQLHV-UHFFFAOYSA-K- Molecular formula
- C17H7K3O9
- Average molar mass
- 472.5 g/mol
- Monoisotopic mass
- 471.9001263
Names & identifiers
- Preferred name
- 1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)
- IUPAC
- tripotassium;4-(4-carboxy-3-carboxylatobenzoyl)phthalate
- English name
- tripotassium hydrogen 4,4'-carbonylbisphthalate
- Molecular formula
- C17H7K3O9
- Molecular weight
- 472.52698
Names & synonyms
68226-90-4Tripotassium 4,4'-carbonyldiphthalateEINECS 269-328-1DTXSID008899531,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3)1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, tripotassium salt4,4'-Carbonylbis(1,2-benzenedicarboxylic acid), tripotassium saltRefChem:71646DTXCID801029205Tripotassium hydrogen 4,4'-carbonylbisphthalateCOHGWCHNMXQLHV-UHFFFAOYSA-KTripotassium 4-(3-carboxy-4-carboxylatobenzoyl)benzene-1,2-dicarboxylate
Database identifiers
- CAS
68226-90-4- PubChem CID
- 109799
- DTXSID
DTXSID00889953- EC Number
- 269-328-1
Properties
Computed structural properties
- Topological polar surface area
- 175 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 609
Physicochemical properties
- EPA Substance Registry System
- 4 · Tripotassium 4,4'-carbonyldiphthalate (68226-90-4)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2-Benzenedicarboxylic acid, 4,4'-carbonylbis-, potassium salt (1:3): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…