| 中文别名 | 3-Bromo-1-methyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one（54738-70-4） |
| 英文别名 | （54738-70-4);3-Bromo-1-methyl-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one |
| CAS号 | 54738-70-4 |
| SMILES | Cn1c2c(c(=O)[nH]cn2)c(n1)Br |
| Inchi | InChI=1S/C6H5BrN4O/c1-11-5-3(4(7)10-11)6(12)9-2-8-5/h2H,1H3,(H,8,9,12) |
| InchiKey | MODBUWPKWKQQDO-UHFFFAOYSA-N |
| 分子式 Formula | C6H5BrN4O |
| 分子量 Molecular Weight | 229.034 |
| 闪点 FP | 252.0±24.6 ℃ |
| 熔点 Melting point | 296-298 ℃ |
| 沸点 Boiling point | 493.0±30.0 ℃ at 760 mmHg |
| Polarizability极化度 | 18.4±0.5 10-24cm3 |
| 密度 Density | 2.2±0.1 g/cm3 |
| 蒸汽压 Vapor Pressure | 0.0±1.3 mmHg at 25℃ |
| 储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |
