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代-1-十二 烷醇磷酸二氢酯
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Henicosafluorododecyl dihydrogen phosphate · CAS 57678-05-4
- 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代-1-十二 烷醇磷酸二氢酯
- 中文别名
- 暂无
- 英文名
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Henicosafluorododecyl dihydrogen phosphate
- CAS
- 57678-05-4
- CID
- 93767
- IUPAC 名称
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl dihydrogen 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代-1-十二 烷醇磷酸二氢酯
- 中文别名
- 暂无
- 英文名
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Henicosafluorododecyl dihydrogen phosphate
- CAS
- 57678-05-4
- CID
- 93767
- IUPAC 名称
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl dihydrogen phosphate
分子属性
- 分子式
- C12H6F21O4P
- 分子量
- 644.11 g/mol
- 精确质量
- 643.9668371 Da
- 单同位素质量
- 643.9668371 Da
- XLogP
- 6
- 极性表面积
- 66.8 Ų
- 氢键供体
- 2
- 氢键受体
- 25
- 可旋转键
- 12
- 重原子数
- 38
- 净电荷
- 0
- 结构复杂度
- 902
结构标识
- InChIKey
- MCYKSXMNSXNCIY-UHFFFAOYSA-N
- SMILES
- C(COP(=O)(O)O)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
- InChI
- InChI=1S/C12H6F21O4P/c13-3(14,1-2-37-38(34,35)36)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)11(29,30)12(31,32)33/h1-2H2,(H2,34,35,36)