299
Summary
| Name: | 2,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATE |
| Synonyms: | RU78299 |
| Formula: | C9 H9 O6 P |
| Formal charge: | 0 |
| Formula weight: | 244.138 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,6-diformyl-4-methylphenyl dihydrogen phosphate |
| OpenEye OEToolkits | 1.5.0 | (2,6-dimethanoyl-4-methyl-phenyl) dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=P(Oc1c(cc(cc1C=O)C)C=O)(O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | Cc1cc(C=O)c(O[P](O)(O)=O)c(C=O)c1 |
| SMILES | CACTVS | 3.341 | Cc1cc(C=O)c(O[P](O)(O)=O)c(C=O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1cc(c(c(c1)C=O)OP(=O)(O)O)C=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | Cc1cc(c(c(c1)C=O)OP(=O)(O)O)C=O |
| InChI | InChI | 1.03 | InChI=1S/C9H9O6P/c1-6-2-7(4-10)9(8(3-6)5-11)15-16(12,13)14/h2-5H,1H3,(H2,12,13,14) |
| InChIKey | InChI | 1.03 | NAYNUXXSJZLKPW-UHFFFAOYSA-N |
