Z6X
Summary
| Name: | 3-oxotetradecanoic acid |
| Formula: | C14 H26 O3 |
| Formal charge: | 0 |
| Formula weight: | 242.354 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-oxotetradecanoic acid |
| OpenEye OEToolkits | 1.7.6 | 3-oxidanylidenetetradecanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(CCCCCCCCCCC)CC(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C14H26O3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h2-12H2,1H3,(H,16,17) |
| InChIKey | InChI | 1.03 | XLKOZYOVXNPWGT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCCCCC(=O)CC(O)=O |
| SMILES | CACTVS | 3.370 | CCCCCCCCCCCC(=O)CC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCCCC(=O)CC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCCCC(=O)CC(=O)O |
