MHH
Summary
| Name: | methyl hydrogen (R)-hexylphosphonate |
| Formula: | C7 H17 O3 P |
| Formal charge: | 0 |
| Formula weight: | 180.182 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | methyl hydrogen (R)-hexylphosphonate |
| OpenEye OEToolkits | 1.5.0 | hexyl-methoxy-phosphinic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(OC)CCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCC[P@](O)(=O)OC |
| SMILES | CACTVS | 3.341 | CCCCCC[P](O)(=O)OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCC[P@@](=O)(O)OC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCP(=O)(O)OC |
| InChI | InChI | 1.03 | InChI=1S/C7H17O3P/c1-3-4-5-6-7-11(8,9)10-2/h3-7H2,1-2H3,(H,8,9) |
| InChIKey | InChI | 1.03 | FOQQOPHBXMFLMD-UHFFFAOYSA-N |
