KIA
Summary
| Name: | 2,6-dimethoxycyclohexa-2,5-diene-1,4-dione |
| Synonyms: | 2,6-dimethoxy-p-benzoquinone |
| Formula: | C8 H8 O4 |
| Formal charge: | 0 |
| Formula weight: | 168.147 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,6-dimethoxycyclohexa-2,5-diene-1,4-dione |
| OpenEye OEToolkits | 1.5.0 | 2,6-dimethoxycyclohexa-2,5-diene-1,4-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1C(OC)=CC(=O)C=C1OC |
| SMILES_CANONICAL | CACTVS | 3.341 | COC1=CC(=O)C=C(OC)C1=O |
| SMILES | CACTVS | 3.341 | COC1=CC(=O)C=C(OC)C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COC1=CC(=O)C=C(C1=O)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | COC1=CC(=O)C=C(C1=O)OC |
| InChI | InChI | 1.03 | InChI=1S/C8H8O4/c1-11-6-3-5(9)4-7(12-2)8(6)10/h3-4H,1-2H3 |
| InChIKey | InChI | 1.03 | OLBNOBQOQZRLMP-UHFFFAOYSA-N |
