Chemical Name - Monocalcium Phosphate
Mol Weight - 95.9779
Smiles - [O-]P([O-])(O)=O.[Ca+2]
Mol Weight - 95.9779
Smiles - [O-]P([O-])(O)=O.[Ca+2]
| Property Value | |
| Mol Name | Monocalcium Phosphate |
| Molweight | 95.9779 |
| Monoisotopic Mass | 95.961247 |
| Clogp | -7.5345 |
| Clogs | 1.958 |
| H Acceptors | 4 |
| H Donors | 1 |
| Total Surface Area | 58.68 |
| Relative Psa | 1 |
| Polar Surface Area | 93.23 |
| Druglikeness | -14.758 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.6 |
| Molecular Complexity | 0.69315 |
| Fragments | 2 |
| Non H Atoms | 5 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Sp3 Atoms | 4 |
| Symmetric Atoms | 1 |
| Acidic Oxygens | 3 |
| Smiles | [O-]P([O-])(O)=O.[Ca+2] |
| InChIKey | InChI=1S/Ca.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+2;/p-2 |
| InChI | FUFJGUQYACFECW-UHFFFAOYSA-L |
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1 - Monocalcium Phosphate
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