3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10 ,11,11,12,12,12-二十一氟-1-十二烷 醇)磷酸氢铵
Ammonium bis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl) phosphate · CAS 93776-21-7
- 中文名
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10 ,11,11,12,12,12-二十一氟-1-十二烷 醇)磷酸氢铵
- 中文别名
- 暂无
- 英文名
- Ammonium bis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl) phosphate
- CAS
- 93776-21-7
- CID
- 3022254
- IUPAC 名称
- azanium bis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl) phosphate
名称与编号
- 中文名
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10 ,11,11,12,12,12-二十一氟-1-十二烷 醇)磷酸氢铵
- 中文别名
- 暂无
- 英文名
- Ammonium bis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl) phosphate
- CAS
- 93776-21-7
- CID
- 3022254
- IUPAC 名称
- azanium bis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl) phosphate
分子属性
- 分子式
- C24H12F42NO4P
- 分子量
- 1207.3 g/mol
- 精确质量
- 1206.9833277 Da
- 单同位素质量
- 1206.9833277 Da
- XLogP
- 暂无
- 极性表面积
- 59.6 Ų
- 氢键供体
- 1
- 氢键受体
- 46
- 可旋转键
- 24
- 重原子数
- 72
- 净电荷
- 0
- 结构复杂度
- 1780
结构标识
- InChIKey
- MUIQKLWXCDMTSP-UHFFFAOYSA-N
- SMILES
- C(COP(=O)([O-])OCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.[NH4+]
- InChI
- InChI=1S/C24H9F42O4P.H3N/c25-5(26,7(29,30)9(33,34)11(37,38)13(41,42)15(45,46)17(49,50)19(53,54)21(57,58)23(61,62)63)1-3-69-71(67,68)70-4-2-6(27,28)8(31,32)10(35,36)12(39,40)14(43,44)16(47,48)18(51,52)20(55,56)22(59,60)24(64,65)66;/h1-4H2,(H,67,68);1H3