CAS NO: | 1269662-73-8 |
包装: | 1mg |
市场价: | 9310元 |
英文别名 | 1269662-73-8;Pyrotinib |
CAS号 | 1269662-73-8 |
SMILES | CCOc1cc2c(cc1NC(=O)/C=C/[C@H]3CCCN3C)c(c(cn2)C#N)Nc4ccc(c(c4)Cl)OCc5ccccn5 |
Inchi | InChI=1S/C32H31ClN6O3/c1-3-41-30-17-27-25(16-28(30)38-31(40)12-10-24-8-6-14-39(24)2)32(21(18-34)19-36-27)37-22-9-11-29(26(33)15-22)42-20-23-7-4-5-13-35-23/h4-5,7,9-13,15-17,19,24H,3,6,8,14,20H2,1-2H3,(H,36,37)(H,38,40)/b12-10+/t24-/m1/s1 |
InchiKey | SADXACCFNXBCFY-IYNHSRRRSA-N |
分子式 Formula | C32H31ClN6O3 |
分子量 Molecular Weight | 583.08 |
闪点 FP | 422.8±32.9 ℃ |
沸点 Boiling point | 775.5±60.0 ℃ at 760 mmHg |
Polarizability极化度 | 64.3±0.5 10-24cm3 |
密度 Density | 1.4±0.1 g/cm3 |
蒸汽压 Vapor Pressure | 0.0±2.7 mmHg at 25℃ |
储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |