triethyl(2,2,3,3-tetrafluoropropyl)azanium trifluoromethanesulfonate

• ChemBase编号: 12139
• 分子式: C10H18F7NO3S
• 平均质量: 365.3086424
• 单一同位素质量: 365.08956198
• SMILES: S(=O)(=O)([O-])C(F)(F)F.C([N+](CC)(CC)CC)C(C(F)F)(F)F
• Canonical SMILES: FC(S(=O)(=O)[O-])(F)F.CC[N+](CC(C(F)F)(F)F)(CC)CC
• InChI: InChI=1S/C9H18F4N.CHF3O3S/c1-4-14(5-2,6-3)7-9(12,13)8(10)11;2-1(3,4)8(5,6)7/h8H,4-7H2,1-3H3;(H,5,6,7)/q+1;/p-1
• InChIKey: LBLGOBSMJLBDLB-UHFFFAOYSA-M

名称和登记号

名称

• IUPAC标准名: triethyl(2,2,3,3-tetrafluoropropyl)azanium trifluoromethanesulfonate
• IUPAC传统名: triethyl(2,2,3,3-tetrafluoropropyl)azanium triflate
• 别名: 2,2,3,3-Tetrafluoropropyltriethylammonium triflate; 2,2,3,3-Tetrafluoropropyl triethylammonium triflate 97%

登记号

• MDL号: MFCD04038359
• PubChem SID: 160975446
• PubChem CID: 6093612

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): -1.7347648
• LogD (pH = 7.4): -1.7347648
• Log P: -1.7347648
• 摩尔折射率: 59.3759 cm^3
• 极化性: 17.913404 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 7
• 里宾斯基五规则: true

分子性质

安全信息

• 保存注意事项: IRRITANT; Irritant
• TSCA收录: false

产品相关信息

• 纯度: 97%