1. Primary Information
| English name: | Dibasic Calcium Phosphate Dihydrate |
| CAS No.: | 7789-77-7 |
| Molecular formula: | CAH5O6P |
| Molecular weight: | 172.09 g/mol |
| SMILES: | O.O.OP(=O)([O-])[O-].[Ca+2] |
| Structural class: | |
| Other identifiers: |
brushite calcium monohydrogen phosphate dihydrate calcium phosphate, dibasic calcium phosphate, dibasic, dihydrate calcium phosphate, dihydrate (1:1) |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 500g | AR，98% | 38 | RT | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
calcium;hydrogen phosphate;dihydrate
4.2 InChI
InChI=1S/Ca.H3O4P.2H2O/c;1-5(2,3)4;;/h;(H3,1,2,3,4);2*1H2/q+2;;;/p-2
4.3 InChIKey
XAAHAAMILDNBPS-UHFFFAOYSA-L
4.4 Canonical SMILES
O.O.OP(=O)([O-])[O-].[Ca+2]
4.5 Isomeric SMILES
-
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
Coming soon
5.2 1H nuclear magnetic resonance (1H NMR)
Coming soon
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 --
