1DB
Summary
| Name: | 1-DECANE-SULFONIC-ACID |
| Synonyms: | DECANE-1-SULFONIC ACID |
| Formula: | C10 H22 O3 S |
| Formal charge: | 0 |
| Formula weight: | 222.345 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | decane-1-sulfonic acid |
| OpenEye OEToolkits | 1.5.0 | decane-1-sulfonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(O)CCCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCC[S](O)(=O)=O |
| SMILES | CACTVS | 3.341 | CCCCCCCCCC[S](O)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCS(=O)(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCS(=O)(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C10H22O3S/c1-2-3-4-5-6-7-8-9-10-14(11,12)13/h2-10H2,1H3,(H,11,12,13) |
| InChIKey | InChI | 1.03 | KVGOXGQSTGQXDD-UHFFFAOYSA-N |
