N,N'-[磷酸亚基双(氧-2,1-乙二烷 基)]双[N-乙基 -1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-十 五氟-1-庚烷基磺酰胺]铵盐的二维分子结构

N,N'-[磷酸亚基双(氧-2,1-乙二烷 基)]双[N-乙基 -1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-十 五氟-1-庚烷基磺酰胺]铵盐

1-Heptanesulfonamide, N,N'-(phosphinicobis(oxy-2,1-ethanediyl))bis(N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro-, ammonium salt (1:1) · CAS 67939-97-3

中文名
N,N'-[磷酸亚基双(氧-2,1-乙二烷 基)]双[N-乙基 -1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-十 五氟-1-庚烷基磺酰胺]铵盐
中文别名
暂无
英文名
1-Heptanesulfonamide, N,N'-(phosphinicobis(oxy-2,1-ethanediyl))bis(N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro-, ammonium salt (1:1)
CAS
67939-97-3
CID
163170
IUPAC 名称
azanium bis[2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsulfonyl)amino]ethyl] phosphate

名称与编号

中文名
N,N'-[磷酸亚基双(氧-2,1-乙二烷 基)]双[N-乙基 -1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-十 五氟-1-庚烷基磺酰胺]铵盐
中文别名
暂无
英文名
1-Heptanesulfonamide, N,N'-(phosphinicobis(oxy-2,1-ethanediyl))bis(N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoro-, ammonium salt (1:1)
CAS
67939-97-3
CID
163170
IUPAC 名称
azanium bis[2-[ethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptylsulfonyl)amino]ethyl] phosphate

分子属性

分子式
C22H22F30N3O8PS2
分子量
1121.5 g/mol
精确质量
1121.0106889 Da
单同位素质量
1121.0106889 Da
XLogP
暂无
极性表面积
151 Ų
氢键供体
1
氢键受体
40
可旋转键
24
重原子数
66
净电荷
0
结构复杂度
1800

结构标识

InChIKey
ULMQTDIUFJYOLD-UHFFFAOYSA-N
SMILES
CCN(CCOP(=O)([O-])OCCN(CC)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)S(=O)(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[NH4+]
InChI
InChI=1S/C22H19F30N2O8PS2.H3N/c1-3-53(64(57,58)21(49,50)17(39,40)13(31,32)9(23,24)11(27,28)15(35,36)19(43,44)45)5-7-61-63(55,56)62-8-6-54(4-2)65(59,60)22(51,52)18(41,42)14(33,34)10(25,26)12(29,30)16(37,38)20(46,47)48;/h3-8H2,1-2H3,(H,55,56);1H3

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