KNA
Summary
| Name: | nonanoic acid |
| Formula: | C9 H18 O2 |
| Formal charge: | 0 |
| Formula weight: | 158.238 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | nonanoic acid |
| OpenEye OEToolkits | 1.7.2 | nonanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(O)CCCCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11) |
| InChIKey | InChI | 1.03 | FBUKVWPVBMHYJY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCC(O)=O |
| SMILES | CACTVS | 3.370 | CCCCCCCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCCCCCCCC(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCCCCCCCC(=O)O |
