1. Primary Information
| English name: | Potassium hydrogen phthalate |
| CAS No.: | 877-24-7 |
| Molecular formula: | C8H5KO4 |
| Molecular weight: | 204.22 g/mol |
| SMILES: | C1=CC=C(C(=C1)C(=O)O)C(=O)[O-].[K+] |
| Structural class: | |
| Other identifiers: |
disodium phthalate phthalate phthalic acid phthalic acid, copper salt phthalic acid, dipotassium salt |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 500g | AR，99.8% | 48 | RT | in stock | - |
| Kehua Intelligence | 50g | 基准试剂 | 40 | RT | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
potassium;2-carboxybenzoate
4.2 InChI
InChI=1S/C8H6O4.K/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+1/p-1
4.3 InChIKey
IWZKICVEHNUQTL-UHFFFAOYSA-M
4.4 Canonical SMILES
C1=CC=C(C(=C1)C(=O)O)C(=O)[O-].[K+]
4.5 Isomeric SMILES
-
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
Coming soon
5.4 Infrared spectroscopy (IR)
Coming soon
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
Coming soon
-- No 3D model data available --
