HDS
Summary
| Name: | 1-HEXADECANOSULFONIC ACID |
| Formula: | C16 H34 O3 S |
| Formal charge: | 0 |
| Formula weight: | 306.504 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | hexadecane-1-sulfonic acid |
| OpenEye OEToolkits | 1.5.0 | hexadecane-1-sulfonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(O)CCCCCCCCCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCCCCCCC[S](O)(=O)=O |
| SMILES | CACTVS | 3.341 | CCCCCCCCCCCCCCCC[S](O)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCCS(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCCCCCCS(=O)(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C16H34O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(17,18)19/h2-16H2,1H3,(H,17,18,19) |
| InChIKey | InChI | 1.03 | SSILHZFTFWOUJR-UHFFFAOYSA-N |
