RXK
Summary
| Name: | cyclohexanecarboxylic acid |
| Formula: | C7 H12 O2 |
| Formal charge: | 0 |
| Formula weight: | 128.169 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | cyclohexanecarboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9) |
| InChIKey | InChI | 1.03 | NZNMSOFKMUBTKW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)C1CCCCC1 |
| SMILES | CACTVS | 3.385 | OC(=O)C1CCCCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CCC(CC1)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CCC(CC1)C(=O)O |
