| Pubchem ID | 24862 |
|---|---|
| CAS | 10045-87-1 |
| IUPAC name | sodium;iron(3+);phosphonato phosphate |
| Synonyms | Iron sodium diphosphate|Sodium ferric pyrophosphate|Diphosphoric acid, iron(3+) sodium salt|10213-96-4|Iron(3+) sodium pyrophosphate |
| Categories | Solvent |
| SMILES | [O-]P(=O)([O-])OP(=O)([O-])[O-].[Na+].[Fe+3] |
| InCheykey | InChI=1S/Fe.Na.H4O7P2/c;;1-8(2,3)7-9(4,5)6/h;;(H2,1,2,3)(H2,4,5,6)/q+3;+1;/p-4 |
| Natural | nan |
| E No. | - |
| GHS Siginal | - |
| ADI Value | - |
Physicochemical Properties
| Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
|---|---|---|---|---|
| 252.775 | 0 | 7 | 0 | 136.0 |
ADME Predicted Parameters
| Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
|---|---|---|---|---|---|
| Very Low Absorption | Too Soluble | Weaker / Non binder | Undefined | Non - Inhibitor | Toxic |
Toxicity Predicted Parameters
| Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
|---|---|---|---|---|---|---|
| Carcinogen | Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Non-Degradable |