1,3-Benzenediol, 2,4,6-trinitro-, magnesium salt (1:1) (Predicted)
(right click,save link as to download,it is a temp file,please download as soon as possible, you can also use CTRL+S to save the whole html page)
Basic Info
| FADB-China ID | P2496 |
| Molecular Name | 1,3-Benzenediol, 2,4,6-trinitro-, magnesium salt (1:1) |
| Basis for prediction | 2,4-dinitrophenol |
| Similarity (based on Tanimoto coefficient and ECFP6 fingerprint) | 0.4176 |
| Similarity (based on Tanimoto coefficient and Daylight fingerprint) | 0.8778 |
| Similarity (based on MCS) | 0.7222 |
| 2D Structure | |
| SMILES | O=[N+]([O-])c1cc([N+](=O)[O-])c([O-])c([N+](=O)[O-])c1[O-].[Mg+2] |
| CFM-ID 3.0 (Copy SMILES to the website's input box) | URL Link |
| Update Date | Jul 30, 2019 14:16 |
References
| Title | Data Sources |
|---|---|
| Source | HPV EPA Chemicals |
| PubChem Link | URL Link |