DC1
Summary
| Name: | 5,5-DIMETHYLCYCLOHEXANE-1,3-DIONE |
| Synonyms: | 2,2 DIMETHYL,1,6 CYCLOHEXA DIONE DIMEDONE |
| Formula: | C8 H12 O2 |
| Formal charge: | 0 |
| Formula weight: | 140.18 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5,5-dimethylcyclohexane-1,3-dione |
| OpenEye OEToolkits | 1.5.0 | 5,5-dimethylcyclohexane-1,3-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1CC(=O)CC(C)(C)C1 |
| SMILES_CANONICAL | CACTVS | 3.341 | CC1(C)CC(=O)CC(=O)C1 |
| SMILES | CACTVS | 3.341 | CC1(C)CC(=O)CC(=O)C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1(CC(=O)CC(=O)C1)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1(CC(=O)CC(=O)C1)C |
| InChI | InChI | 1.03 | InChI=1S/C8H12O2/c1-8(2)4-6(9)3-7(10)5-8/h3-5H2,1-2H3 |
| InChIKey | InChI | 1.03 | BADXJIPKFRBFOT-UHFFFAOYSA-N |
