英文别名 | 4-[(2S)-2-(Methylamino)-3-oxo-3-(4-phenyl-1-piperazinyl)propyl]phenyl 5-isoquinolinesulfonate |
CAS号 | 1391068-10-2 |
SMILES | CN[C@@H](Cc1ccc(cc1)OS(=O)(=O)c2cccc3c2ccnc3)C(=O)N4CCN(CC4)c5ccccc5 |
Inchi | InChI=1S/C29H30N4O4S/c1-30-27(29(34)33-18-16-32(17-19-33)24-7-3-2-4-8-24)20-22-10-12-25(13-11-22)37-38(35,36)28-9-5-6-23-21-31-15-14-26(23)28/h2-15,21,27,30H,16-20H2,1H3/t27-/m0/s1 |
InchiKey | NXMWYNHVTRXLKA-MHZLTWQESA-N |
分子式 Formula | C29H30N4O4S |
分子量 Molecular Weight | 531 |
闪点 FP | 421.3±32.9 ℃ |
沸点 Boiling point | 773.0±60.0 ℃ at 760 mmHg |
Polarizability极化度 | 58.9±0.5 10-24cm3 |
密度 Density | 1.3±0.1 g/cm3 |
蒸汽压 Vapor Pressure | 0.0±2.6 mmHg at 25℃ |
储藏条件 Storage conditions | storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years) |