bis(pentafluorophenyl)(phenyl)phosphane

• ChemBase编号: 99886
• 分子式: C18H5F10P
• 平均质量: 442.190093
• 单一同位素质量: 441.99691899
• SMILES: P(c1ccccc1)(c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F
• Canonical SMILES: Fc1c(P(c2c(F)c(F)c(c(c2F)F)F)c2ccccc2)c(F)c(c(c1F)F)F
• InChI: InChI=1S/C18H5F10P/c19-7-9(21)13(25)17(14(26)10(7)22)29(6-4-2-1-3-5-6)18-15(27)11(23)8(20)12(24)16(18)28/h1-5H
• InChIKey: OYNXPGGNQMSMTR-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: bis(pentafluorophenyl)(phenyl)phosphane
• IUPAC传统名: bis(pentafluorophenyl)(phenyl)phosphane
• 别名: 2,3,4,5,6,2′,3′,4′,5′,6′-十氟三苯基膦; 双(五氟苯基)苯膦; 双(五氟苯基)苯膦; 十氟三苯基磷; Bis(pentafluorophenyl)phenylphosphine; Bis(perfluorophenyl)phenylphosphine; DFTPP; Massmark 443; Decafluorotriphenylphosphine; Phenylbis(pentafluorophenyl)phosphine; 2,3,4,5,6,2′,3′,4′,5′,6′-Decafluorotriphenylphosphine; Bis(pentafluorophenyl)phenylphosphine; Decafluorotriphenylphosphine

登记号

• CAS号: 5074-71-5
• EC号: 225-780-1
• MDL号: MFCD00000291
• Beilstein号: 6253897
• PubChem SID: 24853303; 162086133; 24867900; 24888583
• PubChem CID: 78757

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 6.5016
• LogD (pH = 7.4): 6.5016
• Log P: 6.5016
• 摩尔折射率: 83.7869 cm^3
• 极化性: 30.180931 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 3
• 里宾斯基五规则: false

分子性质

理化性质

• 熔点: 55-60 °C; 55-60 °C(lit.); 55-65°C; 59-64°C
• 沸点: 105°C/0.2mm; 105°C/0.3mm
• 闪点: >110°C; >110°C(230°F); 113 °C; 235 °F; 235.4 °F

安全信息

• 保存注意事项: Harmful/Irritant
• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 德国WGK号: 3
• 危险公开号: 36/37/38
• 安全公开号: 26-36/37/39; 26-37
• TSCA收录: 否
• GHS危险品标识: GHS07
• GHS警示词: Warning
• GHS危险声明: H315-H319-H335
• GHS警示性声明: P261-P305 + P351 + P338; P261-P305+P351+P338-P302+P352-P321-P405-P501A
• 个人保护装置: dust mask type N95 (US), Eyeshields, Gloves

产品相关信息

• 纯度: 90%; 97%
• 级别: analytical standard; analytical standard, for mass spectrometry; technical grade
• 包装: ampule of 100 mg
• 线性分子式: C6H5P(C6F5)2

详细说明

Apollo Scientific Ltd - PC7946

Fluorinated mass marker up to mass 443

Sigma Aldrich - 221961

Application
离子丰度标定和 GC-MS 仪器性能评估的校准标准品。