Edetate monocalcium
calcium 2-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetate
| Molecular Formula | C10H14CaN2O8 |
|---|---|
| Molecular Weight | 330.3 g/mol |
| Topological Polar Surface Area | 161.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 330.0376 |
| Heavy Atoms | 21 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 12264-18-5 |
|---|---|
| SMILES | C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Ca+2] |
| InChIKey | NVTRPRFAWJGJAJ-UHFFFAOYSA-L |
📖 Product Overview
Edetate monocalcium (CAS: 12264-18-5) is a chemical compound with molecular formula C10H14CaN2O8 and molecular weight 330.3 g/mol. Its IUPAC systematic name is calcium 2-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetate.
NVTRPRFAWJGJAJ-UHFFFAOYSA-L.
SMILES: C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Ca+2].
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