4-[3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL]BENZENE-1,3-DISULPHONIC ACID

CAS号
85681-99-8
CCD编号
CCD08043081
分子式
C27 H32 N2 O7 S2
分子量
560.689

基本信息

产品名称: 4-[3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL]BENZENE-1,3-DISULPHONIC ACID
CAS: 85681-99-8
英文同义词: 4-[3,6-BIS(DIETHYLAMINO)-9H-XANTHEN-9-YL]BENZENE-1,3-DISULPHONIC ACID
MDL号: MFCD00475866
氢键受体数量: 9
氢键供体数量: 2
Smile: CCN(CC)c1ccc2c(c1)Oc3cc(ccc3C2c4ccc(cc4S(=O)(=O)O)S(=O)(=O)O)N(CC)CC
InChi: InChI=1S/C27H32N2O7S2/c1-5-28(6-2)18-9-12-21-24(15-18)36-25-16-19(29(7-3)8-4)10-13-22(25)27(21)23-14-11-20(37(30,31)32)17-26(23)38(33,34)35/h9-17,27H,5-8H2,1-4H3,(H,30,31,32)(H,33,34,35)
InChiKey: InChIKey=ZMQJXVGDHQCYTO-UHFFFAOYSA-N

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