5ZG
Summary
| Name: | ethyl-4-methylbenzylphosphonate |
| Formula: | C10 H15 O3 P |
| Formal charge: | 0 |
| Formula weight: | 214.198 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ethoxy-[(4-methylphenyl)methyl]phosphinic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H15O3P/c1-3-13-14(11,12)8-10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3,(H,11,12) |
| InChIKey | InChI | 1.03 | UGYWRBROZXWBSU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCO[P](O)(=O)Cc1ccc(C)cc1 |
| SMILES | CACTVS | 3.385 | CCO[P](O)(=O)Cc1ccc(C)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOP(=O)(Cc1ccc(cc1)C)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOP(=O)(Cc1ccc(cc1)C)O |
