5455-90-3
中文名称
7-(((4AS,8AR)-OCTAHYDROQUINOLIN-1(2H)-YL)SULFONYL)-1,2,3,4-TETRAHYDROQUINOLINE
英文名称
6-[(4ar,8as)-octahydroquinolin-1(2H)-ylsulfonyl]-1,2,3,4-tetrahydroquinoline
CAS
5455-90-3
分子式
C18H26N2O2S
分子量
334.48
MOL 文件
5455-90-3.mol
5455-90-3 结构式
基本信息
英文别名
6-[(4ar,8as)-octahydroquinolin-1(2H)-ylsulfonyl]-1,2,3,4-tetrahydroquinoline7-(((4aS,8aR)-octahydroquinolin-1(2H)-yl)sulfonyl)-1,2,3,4-tetrahydroquinoline
Quinoline, decahydro-1-[(1,2,3,4-tetrahydro-6-quinolinyl)sulfonyl]-, trans- (9CI)
6-[[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]sulfonyl]-1,2,3,4-tetrahydroquinoline
物理化学性质
沸点517.8±60.0 °C(Predicted)
密度1.196±0.06 g/cm3(Predicted)
储存条件+2C to +8C
溶解度DMSO: 50mg/mL
酸度系数(pKa)1.73±0.20(Predicted)
形态White solid
颜色white
InChI1S/C18H26N2O2S/c21-23(22,16-9-10-17-15(13-16)6-3-11-19-17)20-12-4-7-14-5-1-2-8-18(14)20/h9-10,13-14,18-19H,1-8,11-12H2/t14-,18+/m1/s1
InChIKeyLECPJKATPJRAMB-KDOFPFPSSA-N
SMILES[S](=O)(=O)(N3[C@@H]4[C@@H](CCC3)CCCC4)c1cc2c(cc1)NCCC2