1,1,2,2-tetrafluoro-2-({1,1,1,2,3,3-hexafluoro-3-[(trifluoroethenyl)oxy]propan-2-yl}oxy)ethane-1-sulfonyl fluoride

• ChemBase编号: 6438
• 分子式: C7F14O4S
• 平均质量: 446.1151448
• 单一同位素质量: 445.92937456
• SMILES: S(=O)(=O)(F)C(C(OC(C(OC(=C(F)F)F)(F)F)(C(F)(F)F)F)(F)F)(F)F
• Canonical SMILES: FC(=C(F)F)OC(C(C(F)(F)F)(OC(C(S(=O)(=O)F)(F)F)(F)F)F)(F)F
• InChI: InChI=1S/C7F14O4S/c8-1(9)2(10)24-5(15,16)3(11,4(12,13)14)25-6(17,18)7(19,20)26(21,22)23
• InChIKey: KTCQQCLZUOZFEI-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1,1,2,2-tetrafluoro-2-({1,1,1,2,3,3-hexafluoro-3-[(trifluoroethenyl)oxy]propan-2-yl}oxy)ethane-1-sulfonyl fluoride
• IUPAC传统名: 1,1,2,2-tetrafluoro-2-({1,1,1,2,3,3-hexafluoro-3-[(trifluoroethenyl)oxy]propan-2-yl}oxy)ethanesulfonyl fluoride
• 别名: Perfluoro(4-methyl-3,6-dioxaoct-7-ene)-sulfonyl fluoride; 2-({1,1,1,2,3,3-Hexafluoro-3-[(trifluoroethenyl)oxy]prop-2-yl}oxy)-1,1,2,2-tetrafluoroethanesulphonyl fluoride; Perfluoro-3,6-dioxa-4-methyloct-7-enesulphonyl fluoride

登记号

• CAS号: 16090-14-5
• MDL号: MFCD00798138
• PubChem SID: 160969745
• PubChem CID: 85958

理论计算性质

• 质子受体: 4
• 质子供体: 0
• LogD (pH = 5.5): 5.144165
• LogD (pH = 7.4): 5.144165
• Log P: 5.144165
• 摩尔折射率: 69.9184 cm^3
• 极化性: 19.639154 Å^3
• 极化表面积: 52.6 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: 135°C
• 闪点: none°C
• 密度: 1.7

安全信息

• 保存注意事项: Irritant; TOXIC
• TSCA收录: true

产品相关信息

• 纯度: 95%

详细说明

Apollo Scientific Ltd - PC7831

Intermediate for incorporation of sulphonic acid groups into polymers.