787
Summary
| Name: | (PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACID |
| Synonyms: | RU78783 |
| Formula: | C7 H10 O6 P2 |
| Formal charge: | 0 |
| Formula weight: | 252.098 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (phenylmethanediyl)bis(phosphonic acid) |
| OpenEye OEToolkits | 1.5.0 | (phenyl-phosphono-methyl)phosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(O)(O)C(c1ccccc1)P(=O)(O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | O[P](O)(=O)C(c1ccccc1)[P](O)(O)=O |
| SMILES | CACTVS | 3.341 | O[P](O)(=O)C(c1ccccc1)[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C(P(=O)(O)O)P(=O)(O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C(P(=O)(O)O)P(=O)(O)O |
| InChI | InChI | 1.03 | InChI=1S/C7H10O6P2/c8-14(9,10)7(15(11,12)13)6-4-2-1-3-5-6/h1-5,7H,(H2,8,9,10)(H2,11,12,13) |
| InChIKey | InChI | 1.03 | FRLTXWJJMCIUNT-UHFFFAOYSA-N |
