3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10 ,11,11,12,12,13,13,14,14,14-二十 五氟-1-十四烷醇磷酸酯(3:1)
Tris(2-(perfluorododecyl)ethyl)phosphate · CAS 393098-42-5
- 中文名
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10 ,11,11,12,12,13,13,14,14,14-二十 五氟-1-十四烷醇磷酸酯(3:1)
- 中文别名
- 暂无
- 英文名
- Tris(2-(perfluorododecyl)ethyl)phosphate
- CAS
- 393098-42-5
- CID
- 138396274
- IUPAC 名称
- tris(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentacosafluorotetradecyl) 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 ,11,11,12,12,13,13,14,14,14-二十 五氟-1-十四烷醇磷酸酯(3:1)
- 中文别名
- 暂无
- 英文名
- Tris(2-(perfluorododecyl)ethyl)phosphate
- CAS
- 393098-42-5
- CID
- 138396274
- IUPAC 名称
- tris(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,14-pentacosafluorotetradecyl) phosphate
分子属性
- 分子式
- C42H12F75O4P
- 分子量
- 2036.4 g/mol
- 精确质量
- 2035.927558 Da
- 单同位素质量
- 2035.927558 Da
- XLogP
- 26.1
- 极性表面积
- 44.8 Ų
- 氢键供体
- 0
- 氢键受体
- 79
- 可旋转键
- 42
- 重原子数
- 122
- 净电荷
- 0
- 结构复杂度
- 3310
结构标识
- InChIKey
- JKDZBIHMORMGRL-UHFFFAOYSA-N
- SMILES
- C(COP(=O)(OCCC(C(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)(F)F)(F)F)OCCC(C(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)(F)F)(F)F)C(C(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)(F)F)(F)F
- InChI
- InChI=1S/C42H12F75O4P/c43-7(44,10(49,50)13(55,56)16(61,62)19(67,68)22(73,74)25(79,80)28(85,86)31(91,92)34(97,98)37(103,104)40(109,110)111)1-4-119-122(118,120-5-2-8(45,46)11(51,52)14(57,58)17(63,64)20(69,70)23(75,76)26(81,82)29(87,88)32(93,94)35(99,100)38(105,106)41(112,113)114)121-6-3-9(47,48)12(53,54)15(59,60)18(65,66)21(71,72)24(77,78)27(83,84)30(89,90)33(95,96)36(101,102)39(107,108)42(115,116)117/h1-6H2