ZPS
Summary
| Name: | cyclobutane-1,1-dicarboxylic acid |
| Formula: | C6 H8 O4 |
| Formal charge: | 0 |
| Formula weight: | 144.125 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | cyclobutane-1,1-dicarboxylic acid |
| OpenEye OEToolkits | 2.0.7 | cyclobutane-1,1-dicarboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)C1(CCC1)C(O)=O |
| InChI | InChI | 1.03 | InChI=1S/C6H8O4/c7-4(8)6(5(9)10)2-1-3-6/h1-3H2,(H,7,8)(H,9,10) |
| InChIKey | InChI | 1.03 | CCQPAEQGAVNNIA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C1(CCC1)C(O)=O |
| SMILES | CACTVS | 3.385 | OC(=O)C1(CCC1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CC(C1)(C(=O)O)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CC(C1)(C(=O)O)C(=O)O |
