TO4
Summary
| Name: | propan-2-yl (R)-dodec-11-en-1-ylphosphonofluoridate |
| Synonyms: | 11-dodecenyl-phosphonofluoridic acid 1-methylethyl ester |
| Formula: | C15 H30 F O2 P |
| Formal charge: | 0 |
| Formula weight: | 292.37 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | propan-2-yl (R)-dodec-11-en-1-ylphosphonofluoridate |
| OpenEye OEToolkits | 2.0.7 | 12-[fluoranyl(propan-2-yloxy)phosphoryl]dodec-1-ene |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | P(CCCCCCCCCC[C@H]=C)(F)(=O)OC(C)C |
| InChI | InChI | 1.03 | InChI=1S/C15H30FO2P/c1-4-5-6-7-8-9-10-11-12-13-14-19(16,17)18-15(2)3/h4,15H,1,5-14H2,2-3H3/t19-/m1/s1 |
| InChIKey | InChI | 1.03 | HAGAHLUSUUTRJV-LJQANCHMSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)O[P@](F)(=O)CCCCCCCCCCC=C |
| SMILES | CACTVS | 3.385 | CC(C)O[P](F)(=O)CCCCCCCCCCC=C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)O[P@](=O)(CCCCCCCCCCC=C)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)OP(=O)(CCCCCCCCCCC=C)F |
