ANX
Summary
| Name: | 2,5-DINITROPHENOL |
| Formula: | C6 H4 N2 O5 |
| Formal charge: | 0 |
| Formula weight: | 184.106 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,5-dinitrophenol |
| OpenEye OEToolkits | 1.5.0 | 2,5-dinitrophenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=[N+]([O-])c1ccc(cc1O)[N+]([O-])=O |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1cc(ccc1[N+]([O-])=O)[N+]([O-])=O |
| SMILES | CACTVS | 3.341 | Oc1cc(ccc1[N+]([O-])=O)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1[N+](=O)[O-])O)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(c(cc1[N+](=O)[O-])O)[N+](=O)[O-] |
| InChI | InChI | 1.03 | InChI=1S/C6H4N2O5/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3,9H |
| InChIKey | InChI | 1.03 | UWEZBKLLMKVIPI-UHFFFAOYSA-N |
