MU6
Summary
| Name: | dimethylpropanedioic acid |
| Formula: | C5 H8 O4 |
| Formal charge: | 0 |
| Formula weight: | 132.115 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | dimethylpropanedioic acid |
| OpenEye OEToolkits | 2.0.7 | 2,2-dimethylpropanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C(C)(C)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H8O4/c1-5(2,3(6)7)4(8)9/h1-2H3,(H,6,7)(H,8,9) |
| InChIKey | InChI | 1.03 | OREAFAJWWJHCOT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C(O)=O)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(C)(C(O)=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C(=O)O)C(=O)O |
