491611-55-3
| Name | 2,2-DIMETHYL-PROPIONIC ACID 3-(2-CHLORO-6-METHYLAMINOPURIN-9-YL)-2-(2,2-DIMETHYL-PROPIONYLOXYMETHYL)-PROPYL ESTER |
| CAS | 491611-55-3 |
| Molecular Formula | C20H30ClN5O4 |
| MDL Number | MFCD05865235 |
| Molecular Weight | 439.94 |
| MOL File | 491611-55-3.mol |
Chemical Properties
| Boiling point | 532.5±60.0 °C(Predicted) |
| density | 1.26±0.1 g/cm3(Predicted) |
| solubility | DMSO: >10 mg/mL |
| form | solid |
| pka | 1.53±0.10(Predicted) |
| color | white |
| InChI | 1S/C20H30ClN5O4/c1-19(2,3)16(27)29-9-12(10-30-17(28)20(4,5)6)8-26-11-23-13-14(22-7)24-18(21)25-15(13)26/h11-12H,8-10H2,1-7H3,(H,22,24,25) |
| InChIKey | NASABYJQIYJDID-UHFFFAOYSA-N |
| SMILES | CNc1nc(Cl)nc2n(CC(COC(=O)C(C)(C)C)COC(=O)C(C)(C)C)cnc12 |