QMP
Summary
| Name: | cyclohexyl methylphosphonate |
| Formula: | C7 H15 O3 P |
| Formal charge: | 0 |
| Formula weight: | 178.166 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | cyclohexyl hydrogen (R)-methylphosphonate |
| OpenEye OEToolkits | 1.7.6 | cyclohexyloxy(methyl)phosphinic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=P(O)(OC1CCCCC1)C |
| InChI | InChI | 1.03 | InChI=1S/C7H15O3P/c1-11(8,9)10-7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H,8,9) |
| InChIKey | InChI | 1.03 | SWYGLBJVTQMYSE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | C[P](O)(=O)OC1CCCCC1 |
| SMILES | CACTVS | 3.370 | C[P](O)(=O)OC1CCCCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CP(=O)(O)OC1CCCCC1 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CP(=O)(O)OC1CCCCC1 |
