中文别名 |
CP-547632(cas:252003-65-9) |
英文别名 |
CP-547632,252003-65-9 |
CAS号 |
252003-65-9 |
SMILES |
O=C(NC1=C(C(N)=O)C(OCC2=C(F)C=C(Br)C=C2F)=NS1)NCCCCN3CCCC3 |
Inchi |
InChI=1S/C20H24BrF2N5O3S/c21-12-9-14(22)13(15(23)10-12)11-31-18-16(17(24)29)19(32-27-18)26-20(30)25-5-1-2-6-28-7-3-4-8-28/h9-10H,1-8,11H2,(H2,24,29)(H2,25,26,30) |
InchiKey |
HXHAJRMTJXHJJZ-UHFFFAOYSA-N |
分子式 Formula |
C20H24BrF2N5O3S |
分子量 Molecular Weight |
532.4 |
闪点 FP |
285.6±30.1 ℃ |
沸点 Boiling point |
548.6±50.0 ℃ at 760 mmHg |
Polarizability极化度 |
48.5±0.5 10-24cm3 |
密度 Density |
1.5±0.1 g/cm3 |
蒸汽压 Vapor Pressure |
0.0±1.5 mmHg at 25℃ |
溶解度Solubility |
生物体外In Vitro:DMSO溶解度≥ 115 mg/mL(216.00 mM)*"≥" means soluble可溶, but saturation unknown溶解度未知. |
性状 |
Solid |
储藏条件 Storage conditions |
4℃, stored under nitrogen * In solvent溶液中 : -80℃, 6 months月; -20℃, 1 month月 (stored under nitrogen) |