hexadecafluorodecanebis(imidamide)

• ChemBase编号: 12105
• 分子式: C10H6F16N4
• 平均质量: 486.1558912
• 单一同位素质量: 486.03369773
• SMILES: C(=N)(C(C(C(C(C(C(C(C(C(=N)N)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N
• Canonical SMILES: NC(=N)C(C(C(C(C(C(C(C(C(=N)N)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• InChI: InChI=1S/C10H6F16N4/c11-3(12,1(27)28)5(15,16)7(19,20)9(23,24)10(25,26)8(21,22)6(17,18)4(13,14)2(29)30/h(H3,27,28)(H3,29,30)
• InChIKey: XHXXTJKMMCVPCP-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: hexadecafluorodecanebis(imidamide)
• IUPAC传统名: hexadecafluorodecanebis(imidamide)
• 别名: Perfluorosebacamidine; Perfluorosebacamidine 97%

登记号

• CAS号: 865-94-1
• MDL号: MFCD00054684
• PubChem SID: 160975412
• PubChem CID: 2776361

理论计算性质

• 质子受体: 4
• 质子供体: 4
• LogD (pH = 5.5): 3.8665814
• LogD (pH = 7.4): 3.867154
• Log P: 3.8671613
• 摩尔折射率: 80.6152 cm^3
• 极化性: 22.815313 Å^3
• 极化表面积: 99.74 Å^2
• 可自由旋转的化学键: 9
• 里宾斯基五规则: true

分子性质

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%