9OD
Summary
| Name: | (2Z)-9-oxodec-2-enoic acid |
| Synonyms: | 9-keto-2(E)-decenoic acid |
| Formula: | C10 H16 O3 |
| Formal charge: | 0 |
| Formula weight: | 184.232 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (2Z)-9-oxodec-2-enoic acid |
| OpenEye OEToolkits | 1.5.0 | (Z)-9-oxodec-2-enoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(C)CCCCC/C=C\C(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(=O)CCCCC\C=C/C(O)=O |
| SMILES | CACTVS | 3.341 | CC(=O)CCCCCC=CC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(=O)CCCCC\C=C/C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(=O)CCCCCC=CC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C10H16O3/c1-9(11)7-5-3-2-4-6-8-10(12)13/h6,8H,2-5,7H2,1H3,(H,12,13)/b8-6- |
| InChIKey | InChI | 1.03 | INJRDZMWIAYEMM-VURMDHGXSA-N |
