0L1
Summary
| Name: | hexanedioic acid |
| Synonyms: | Adipic acid |
| Formula: | C6 H10 O4 |
| Formal charge: | 0 |
| Formula weight: | 146.141 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | hexanedioic acid |
| OpenEye OEToolkits | 1.7.6 | hexanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CCCCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10) |
| InChIKey | InChI | 1.03 | WNLRTRBMVRJNCN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)CCCCC(O)=O |
| SMILES | CACTVS | 3.370 | OC(=O)CCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C(CCC(=O)O)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | C(CCC(=O)O)CC(=O)O |
