BOY
Summary
| Name: | [(R)-hydroxy(4-methylphenyl)methyl]phosphonic acid |
| Formula: | C8 H11 O4 P |
| Formal charge: | 0 |
| Formula weight: | 202.144 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | [(R)-hydroxy(4-methylphenyl)methyl]phosphonic acid |
| OpenEye OEToolkits | 2.0.6 | [(~{R})-(4-methylphenyl)-oxidanyl-methyl]phosphonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1ccc(cc1)C(P(O)(O)=O)O |
| InChI | InChI | 1.03 | InChI=1S/C8H11O4P/c1-6-2-4-7(5-3-6)8(9)13(10,11)12/h2-5,8-9H,1H3,(H2,10,11,12)/t8-/m1/s1 |
| InChIKey | InChI | 1.03 | AFOAUCXHAIELNA-MRVPVSSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc(cc1)[C@H](O)[P](O)(O)=O |
| SMILES | CACTVS | 3.385 | Cc1ccc(cc1)[CH](O)[P](O)(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1ccc(cc1)[C@H](O)P(=O)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1ccc(cc1)C(O)P(=O)(O)O |
