HDR
Summary
| Name: | HEXADECANE-1-SULFINIC ACID |
| Formula: | C16 H34 O2 S |
| Formal charge: | 0 |
| Formula weight: | 290.505 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.5.0 | hexadecane-1-sulfinic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | CACTVS | 2.87 | CCCCCCCCCCCCCCCCS(O)=O |
| SMILES_CANONICAL | CACTVS | 2.87 | CCCCCCCCCCCCCCCCS(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCC[S@](=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCCS(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C16H34O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(17)18/h2-16H2,1H3,(H,17,18) |
| InChIKey | InChI | 1.03 | HBTBNXFVJYRYGI-UHFFFAOYSA-N |
