DPE
Summary
| Name: | N-UNDECANYLPHOSPHONATE METHYL ESTER GROUP |
| Formula: | C12 H27 O2 P |
| Formal charge: | 0 |
| Formula weight: | 234.315 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | methyl (S)-undecylphosphinate |
| OpenEye OEToolkits | 1.5.0 | 1-methoxyphosphonoylundecane |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(OC)CCCCCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCC[P@@H](=O)OC |
| SMILES | CACTVS | 3.341 | CCCCCCCCCCC[PH](=O)OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCC[P@@H](=O)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCCP(=O)OC |
| InChI | InChI | 1.03 | InChI=1S/C12H27O2P/c1-3-4-5-6-7-8-9-10-11-12-15(13)14-2/h15H,3-12H2,1-2H3 |
| InChIKey | InChI | 1.03 | FYHIOSOXVZDSJI-UHFFFAOYSA-N |
