OCE
Summary
| Name: | octanedioic acid |
| Formula: | C8 H14 O4 |
| Formal charge: | 0 |
| Formula weight: | 174.194 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | octanedioic acid |
| OpenEye OEToolkits | 1.7.0 | octanedioic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CCCCCCC(=O)O |
| SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)CCCCCCC(O)=O |
| SMILES | CACTVS | 3.370 | OC(=O)CCCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(CCCC(=O)O)CCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(CCCC(=O)O)CCC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12) |
| InChIKey | InChI | 1.03 | TYFQFVWCELRYAO-UHFFFAOYSA-N |
