MUP
Summary
| Name: | METHOXYUNDECYLPHOSPHINIC ACID |
| Formula: | C12 H27 O3 P |
| Formal charge: | 0 |
| Formula weight: | 250.315 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | methyl hydrogen (S)-undecylphosphonate |
| OpenEye OEToolkits | 1.5.0 | methoxy-undecyl-phosphinic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(OC)CCCCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCC[P@@](O)(=O)OC |
| SMILES | CACTVS | 3.341 | CCCCCCCCCCC[P](O)(=O)OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCC[P@](=O)(O)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCP(=O)(O)OC |
| InChI | InChI | 1.03 | InChI=1S/C12H27O3P/c1-3-4-5-6-7-8-9-10-11-12-16(13,14)15-2/h3-12H2,1-2H3,(H,13,14) |
| InChIKey | InChI | 1.03 | JBVUSHKPEBKWQP-UHFFFAOYSA-N |
