1,1,2,2-tetrafluoro-2-(prop-2-en-1-yloxy)ethane-1-sulfonyl fluoride

• ChemBase编号: 11807
• 分子式: C5H5F5O3S
• 平均质量: 240.148416
• 单一同位素质量: 239.98795612
• SMILES: C(C(F)(OCC=C)F)(S(=O)(=O)F)(F)F
• Canonical SMILES: C=CCOC(C(S(=O)(=O)F)(F)F)(F)F
• InChI: InChI=1S/C5H5F5O3S/c1-2-3-13-4(6,7)5(8,9)14(10,11)12/h2H,1,3H2
• InChIKey: IMNCTHAFGYFIOE-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 1,1,2,2-tetrafluoro-2-(prop-2-en-1-yloxy)ethane-1-sulfonyl fluoride
• IUPAC传统名: 1,1,2,2-tetrafluoro-2-(prop-2-en-1-yloxy)ethanesulfonyl fluoride
• 别名: 2-[(Prop-2-en-1-yl)oxy]-1,1,2,2-tetrafluoroethanesulphonyl fluoride; 2-(Allyloxy)-1,1,2,2-tetrafluoroethanesulphonyl fluoride 97%; 2-Allyloxy-1,1,2,2-tetrafluoroethanesulfonyl fluoride

登记号

• CAS号: 73606-13-0
• MDL号: MFCD03095419
• PubChem SID: 160975114
• PubChem CID: 2782219

理论计算性质

• 质子受体: 3
• 质子供体: 0
• LogD (pH = 5.5): 2.2810955
• LogD (pH = 7.4): 2.2810955
• Log P: 2.2810955
• 摩尔折射率: 37.2288 cm^3
• 极化性: 14.409585 Å^3
• 极化表面积: 43.37 Å^2
• 可自由旋转的化学键: 5
• 里宾斯基五规则: true

分子性质

理化性质

• 沸点: 112-114°C
• 闪点: none°C

安全信息

• 保存注意事项: IRRITANT; Irritant/Moisture Sensitive/Store under Argon
• TSCA收录: false

产品相关信息

• 纯度: 97%