UDT
Summary
| Name: | O-DECYL HYDROGEN THIOCARBONATE |
| Formula: | C11 H22 O2 S |
| Formal charge: | 0 |
| Formula weight: | 218.356 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | O-decyl hydrogen thiocarbonate |
| OpenEye OEToolkits | 1.5.0 | decoxymethanethioic S-acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OCCCCCCCCCC)S |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCOC(S)=O |
| SMILES | CACTVS | 3.341 | CCCCCCCCCCOC(S)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCOC(=O)S |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCOC(=O)S |
| InChI | InChI | 1.03 | InChI=1S/C11H22O2S/c1-2-3-4-5-6-7-8-9-10-13-11(12)14/h2-10H2,1H3,(H,12,14) |
| InChIKey | InChI | 1.03 | RFWUWWWJCLPVPT-UHFFFAOYSA-N |
