WWK
Summary
| Name: | 3-dodecylsulfanylpropanoic acid |
| Formula: | C15 H30 O2 S |
| Formal charge: | 0 |
| Formula weight: | 274.463 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-dodecylsulfanylpropanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C15H30O2S/c1-2-3-4-5-6-7-8-9-10-11-13-18-14-12-15(16)17/h2-14H2,1H3,(H,16,17) |
| InChIKey | InChI | 1.06 | VKLOPQHLJNFYKK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCCCCCCCCCSCCC(O)=O |
| SMILES | CACTVS | 3.385 | CCCCCCCCCCCCSCCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCCSCCC(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCCCCCCCCCSCCC(=O)O |
