hexacosafluorododecane

• ChemBase编号: 98702
• 分子式: C12F26
• 平均质量: 638.0868832
• 单一同位素质量: 637.95848372
• SMILES: FC(C(C(C(F)(F)C(C(C(F)(F)C(F)(F)C(C(F)(C(F)(C(F)(F)F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• Canonical SMILES: FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F
• InChI: InChI=1S/C12F26/c13-1(14,3(17,18)5(21,22)7(25,26)9(29,30)11(33,34)35)2(15,16)4(19,20)6(23,24)8(27,28)10(31,32)12(36,37)38
• InChIKey: WNZGTRLARPEMIG-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: hexacosafluorododecane
• IUPAC传统名: hexacosafluorododecane
• 别名: 全氟十二烷; Perfluorododecane; Hexacosafluorododecane; Perfluorododecane 97%

登记号

• CAS号: 307-59-5
• EC号: 206-204-8
• MDL号: MFCD00042084
• Beilstein号: 1811139
• PubChem SID: 162085086
• PubChem CID: 78973

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 9.088144
• LogD (pH = 7.4): 9.088144
• Log P: 9.088144
• 摩尔折射率: 59.5492 cm^3
• 极化性: 23.965794 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 11
• 里宾斯基五规则: false

分子性质

理化性质

• 熔点: 72-76°C; 75-77°C
• 沸点: 178°C; 178°C
• 闪点: none°C
• 密度: 1.5

安全信息

• 保存注意事项: Irritant
• TSCA收录: 否

产品相关信息

• 纯度: 97%