(5E)-1,1,1,2,2,3,3,4,4,7,7,8,8,9,9,10,10,10-octadecafluorodec-5-ene

• ChemBase编号: 6740
• 分子式: C10H2F18
• 平均质量: 464.0941376
• 单一同位素质量: 463.98690802
• SMILES: C(=C\C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
• Canonical SMILES: FC(C(C(C(F)(F)F)(F)F)(F)F)(/C=C/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F
• InChI: InChI=1S/C10H2F18/c11-3(12,5(15,16)7(19,20)9(23,24)25)1-2-4(13,14)6(17,18)8(21,22)10(26,27)28/h1-2H/b2-1+
• InChIKey: FSOCDJTVKIHJDC-OWOJBTEDSA-N

名称和登记号

名称

• IUPAC标准名: (5E)-1,1,1,2,2,3,3,4,4,7,7,8,8,9,9,10,10,10-octadecafluorodec-5-ene; 1,1,1,2,2,3,3,4,4,7,7,8,8,9,9,10,10,10-octadecafluorodec-5-ene
• IUPAC传统名: (E)-bis(perfluorobutyl)ethene; therox
• 别名: trans-1,2-Bis(perfluoro-n-butyl)ethylene; trans-5H,6H-Perfluorodec-5-ene; trans-1,2-Bis(nonafluoro-n-butyl)-ethylene 97%

登记号

• CAS号: 84551-43-9
• MDL号: MFCD00055550
• PubChem SID: 160970047
• PubChem CID: 5702804

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 6.8127894
• LogD (pH = 7.4): 6.8127894
• Log P: 6.8127894
• 摩尔折射率: 51.1958 cm^3
• 极化性: 19.131247 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 8
• 里宾斯基五规则: false

分子性质

理化性质

• 沸点: 64°C/56mm
• 密度: 1.675
• 折射率: 1.3; 1.300

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%