OES
Summary
| Name: | N-OCTYL-2-HYDROXYETHYL SULFOXIDE |
| Formula: | C10 H22 O2 S |
| Formal charge: | 0 |
| Formula weight: | 206.345 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-[(R)-octylsulfinyl]ethanol |
| OpenEye OEToolkits | 1.5.0 | 2-[(R)-octylsulfinyl]ethanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(CCCCCCCC)CCO |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCC[S@@](=O)CCO |
| SMILES | CACTVS | 3.341 | CCCCCCCC[S](=O)CCO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCC[S@@](=O)CCO |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCS(=O)CCO |
| InChI | InChI | 1.03 | InChI=1S/C10H22O2S/c1-2-3-4-5-6-7-9-13(12)10-8-11/h11H,2-10H2,1H3/t13-/m1/s1 |
| InChIKey | InChI | 1.03 | IRJUEMKMQDEOTQ-CYBMUJFWSA-N |
