hexafluoro-$l^{5}-phosphanuide; triethyloxidanium

• ChemBase编号: 100603
• 分子式: C6H15F6OP
• 平均质量: 248.1468802
• 单一同位素质量: 248.07647105
• SMILES: [P-](F)(F)(F)(F)(F)F.[O+](CC)(CC)CC
• Canonical SMILES: F[P-](F)(F)(F)(F)F.CC[O+](CC)CC
• InChI: InChI=1S/C6H15O.F6P/c1-4-7(5-2)6-3;1-7(2,3,4,5)6/h4-6H2,1-3H3;/q+1;-1
• InChIKey: JRHIFBONIQGZFC-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: hexafluoro-$l^{5}-phosphanuide; triethyloxidanium; hexafluoro-λ^5-phosphanuide; triethyloxidanium
• IUPAC传统名: hexafluoro-$l^{5}-phosphanuide; triethyloxidanium; triethyloxidanium hexafluorophosphate
• 别名: 三乙基六氟磷氧; Triethyloxonium hexafluorophosphate; Triethyloxonium hexafluorophosphate

登记号

• CAS号: 17950-40-2
• EC号: 241-876-6
• MDL号: MFCD00044222
• Beilstein号: 4302183
• PubChem SID: 24850095; 162087744
• PubChem CID: 167684

理论计算性质

• LogD (pH = 5.5): 0.589
• LogD (pH = 7.4): 0.589
• Log P: 0.589
• 极化性: 14.022011 Å^3
• 质子受体: 1
• 质子供体: 0
• 摩尔折射率: 44.4508 cm^3
• 极化表面积: 13.59 Å^2
• 可自由旋转的化学键: 3
• 里宾斯基五规则: true

分子性质

理化性质

• 熔点: ~145 °C (dec.)(lit.)
• 闪点: 134.6 °F; 135 °F; 57 °C

安全信息

• 保存注意事项: Corrosive/Moisture Sensitive
• 欧盟危险性物质标志: 腐蚀性(Corrosive) (C); 易燃性(Flammable) (F)
• 联合国危险货物编号: 2925
• 德国WGK号: 3
• 联合国危险货物等级: 4.1
• 联合国危险货物包装类别(PG): 2
• 危险公开号: 11-19-35; 35
• 安全公开号: 26-36/37/39-45
• GHS危险品标识: GHS02; GHS05
• GHS警示词: Danger
• GHS危险声明: H228-H314
• GHS警示性声明: P210-P280-P305 + P351 + P338-P310
• 个人保护装置: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 2925 4.1/PG 2
• 欧盟补充危害声明: May form explosive peroxides.
• 保存温度: -20°C

产品相关信息

• 纯度: ≥95.0% (NMR)
• 级别: purum
• 其他组分: ~10% diethyl ether as stabilizer
• 线性分子式: (C2H5)3OPF6

详细说明

Sigma Aldrich - 164682

包装
25 g in glass bottle
5 g in poly bottle
Application
Reactant or reagent involved in:
• Synthesis of ruthenium allenylidene complexes1
• Asymmetric Diels-Alder reactions2
• Chlorine scavenging3
• Synthesis of molecules for studies of wavelength tunability via cis-trans isomerization4
• Reactions with 2-mthylpyridine N-oxide5Catalyst activating agent for asymmetric imine aziridination via diazo ester activation6

Sigma Aldrich - 91651

Application
Reactant or reagent involved in:
• Synthesis of ruthenium allenylidene complexes1
• Asymmetric Diels-Alder reactions2
• Chlorine scavenging3
• Synthesis of molecules for studies of wavelength tunability via cis-trans isomerization4
• Reactions with 2-mthylpyridine N-oxide5Catalyst activating agent for asymmetric imine aziridination via diazo ester activation6