1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane

• ChemBase编号: 7260
• 分子式: C10H4F17I
• 平均质量: 574.0160844
• 单一同位素质量: 573.90862787
• SMILES: FC(C(C(C(C(C(C(C(CCI)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• Canonical SMILES: ICCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• InChI: InChI=1S/C10H4F17I/c11-3(12,1-2-28)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2
• InChIKey: XVKJSLBVVRCOIT-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane
• IUPAC传统名: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane
• 别名: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-十七氟-10-碘癸烷; 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-十七氟-10-碘癸烷; 1-碘-1H,1H,2H,2H-全氟癸烷; 1H,1H,2H,2H-全氟癸基碘烷; 1-碘-1H,1H,2H,2H-全氟癸烷; 1H,1H,2H,2H-Perfluorodecyl iodide; 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane; 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-Heptadecafluoro-10-iododecane; 1H,1H,2H,2H-Perfluoro-1-decyl iodide; 1-Iodo-1H,1H,2H,2H-perfluorodecane; 2-(Perfluorooctyl)ethyl iodide; 1-Iodo-1H,1H,2H,2H-perfluorodecane; 1H,1H,2H,2H-Perfluorodecyl iodide 97%; 1H,1H,2H,2H-Perfluoro-1-iododecane

登记号

• CAS号: 2043-53-0
• EC号: 218-053-5
• MDL号: MFCD00039411
• Beilstein号: 1894667
• PubChem SID: 160970567; 24887348; 24863073
• PubChem CID: 74885

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 7.581686
• LogD (pH = 7.4): 7.581686
• Log P: 7.581686
• 摩尔折射率: 62.1224 cm^3
• 极化性: 24.732702 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 9
• 里宾斯基五规则: false

分子性质

理化性质

• 熔点: 53-57°C; 53-57°C; 54-58 °C; 54-58 °C(lit.); 55-57°C
• 沸点: 178-180°C; 226°C; 92-96°C/12mm
• 闪点: None
• 密度: 1.88

安全信息

• 保存注意事项: Irritant/Light Sensitive/Store under Argon/Keep Cold; IRRITANT-HARMFUL; Light Sensitive
• 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: 26-37; 26-37/39
• TSCA收录: true; 是
• 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; P280G-P305+P351+P338
• 个人保护装置: dust mask type N95 (US), Eyeshields, Gloves

产品相关信息

• 纯度: >95.0% (GC); 96%; 97%
• 级别: purum
• 线性分子式: CF3(CF2)7CH2CH2I

详细说明

Sigma Aldrich - 370525

包装
5, 25 g in glass bottle

Sigma Aldrich - 80219

Other Notes
制备用于氟双相催化的新型高亲氟配体1,2,3