英文别名 |
154992-24-2;RU 58841 |
CAS号 |
154992-24-2 |
SMILES |
CC1(C(=O)N(C(=O)N1CCCCO)c2ccc(c(c2)C(F)(F)F)C#N)C |
Inchi |
InChI=1S/C17H18F3N3O3/c1-16(2)14(25)23(15(26)22(16)7-3-4-8-24)12-6-5-11(10-21)13(9-12)17(18,19)20/h5-6,9,24H,3-4,7-8H2,1-2H3 |
InchiKey |
ARBYGDBJECGMGA-UHFFFAOYSA-N |
分子式 Formula |
C17H18F3N3O3 |
分子量 Molecular Weight |
369.338 |
闪点 FP |
252.3±31.5 ℃ |
沸点 Boiling point |
493.6±55.0 ℃ at 760 mmHg |
Polarizability极化度 |
33.9±0.5 10-24cm3 |
密度 Density |
1.4±0.1 g/cm3 |
蒸汽压 Vapor Pressure |
0.0±1.3 mmHg at 25℃ |
溶解度Solubility |
生物体外In Vitro:DMSO溶解度≥ 100 mg/mL(270.75 mM)*"≥" means soluble可溶, but saturation unknown溶解度未知. |
储藏条件 Storage conditions |
storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |