167631-99-4 ((3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-tricosafluoro-2,5,8,11,14,17-hexakis(trifluoromethyl)-)

CAS号:
167631-99-4
英文名称:
3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-tricosafluoro-2,5,8,11,14,17-hexakis(trifluoromethyl)-
分子式:
C21H3F41O7
分子量:
1146.1788713932

3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-tricosafluoro-2,5,8,11,14,17-hexakis(trifluoromethyl)-(167631-99-4)名称与标识符

名称

英文别名:
3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-tricosafluoro-2,5,8,11,14,17-hexakis(trifluoromethyl)-;1H,1H-PERFLUORO(2,5,8,11,14,17-HEXAMETHYL-3,6,9,12,15,18-HEXAOXAHENEICOSAN-1-OL);3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,...;3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-tricosafluoro-2,5,8,11,14;2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-Tricosafluoro-2,5,8,11,14,17-hexakis-(trifluoromethyl)-3,6,9,12,15,18-hexaoxaheneicosan-1-ol;C3F7O(CF(CF3)CF2O)5CF(CF3)CH2OH;2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-TRICOSAFLUORO-2,5,8,11,14,17-HEXAKIS(TRIFLUOROMETHYL)-3,6,9,12,15,18-HEXAOXAHENICOSAN-1-OL;NS00111136;SAETUWCYSIJUEM-UHFFFAOYSA-N;AKOS015911229;DTXSID60896522;MFCD08460479;1H,1H-Perfluoro-2,5,8,11,14,17-hexamethyl-3,6,9,12,15,18-hexaoxaheneicosan-1-ol;167631-99-4;2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol;

标识符

InChIKey:
SAETUWCYSIJUEM-UHFFFAOYSA-N
Inchi:
1S/C21H3F41O7/c22-2(1-63,9(30,31)32)64-17(53,54)4(25,11(36,37)38)66-19(57,58)6(27,13(42,43)44)68-21(61,62)8(29,15(48,49)50)69-20(59,60)7(28,14(45,46)47)67-18(55,56)5(26,12(39,40)41)65-16(51,52)3(23,24)10(33,34)35/h63H,1H2
SMILES:
FC(C(F)(F)F)(C(OC(C(F)(F)F)(C(OC(C(F)(F)F)(C(OC(C(F)(F)F)(CO)F)(F)F)F)(F)F)F)(F)F)OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F

3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-tricosafluoro-2,5,8,11,14,17-hexakis(trifluoromethyl)-(167631-99-4)物化性质

实验特性

  • LogP : 12.20130
  • PSA : 75.61000

计算特性

  • 精确分子量 : 1145.92000
  • 氢键供体数量 : 1
  • 氢键受体数量 : 48
  • 可旋转化学键数量 : 19
  • 同位素质量 : 1145.9224071g/mol
  • 重原子数量 : 69
  • 复杂度 : 1770
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 6
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 13.7
  • 拓扑分子极性表面积 : 75.6Ų

3,6,9,12,15,18-Hexaoxaheneicosan-1-ol,2,4,4,5,7,7,8,10,10,11,13,13,14,16,16,17,19,19,20,20,21,21,21-tricosafluoro-2,5,8,11,14,17-hexakis(trifluoromethyl)-(167631-99-4)推荐厂家 更多厂家(2)

公司名称手机号/电话联系人QQ微信询单
金锦乐(湖南)化学有限公司 金锦乐 1226360695
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深圳市中发源生物科技有限公司 18129803827
0755-23105005
林小姐 3158423203
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