2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecyl prop-2-enoate

• ChemBase编号: 8123
• 分子式: C13H5F19O2
• 平均质量: 554.1472608
• 单一同位素质量: 553.99861558
• SMILES: C(C(C(C(C(C(C(C(C(COC(=O)C=C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)(F)F
• Canonical SMILES: C=CC(=O)OCC(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• InChI: InChI=1S/C13H5F19O2/c1-2-4(33)34-3-5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)11(26,27)12(28,29)13(30,31)32/h2H,1,3H2
• InChIKey: QPVJROJBHCURKR-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecyl prop-2-enoate
• IUPAC传统名: 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecyl prop-2-enoate
• 别名: 1H,1H-Perfluoro-n-decyl acrylate 97%; 1H,1H-Perfluoro-n-decyl acrylate

登记号

• CAS号: 335-83-1
• MDL号: MFCD02183510
• PubChem SID: 160971430
• PubChem CID: 2760316

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): 7.4724126
• LogD (pH = 7.4): 7.4724126
• Log P: 7.4724126
• 摩尔折射率: 64.8546 cm^3
• 极化性: 25.196177 Å^3
• 极化表面积: 26.3 Å^2
• 可自由旋转的化学键: 12
• 里宾斯基五规则: false

分子性质

理化性质

• 沸点: 66°C/0.35mm
• 折射率: 1.3266

安全信息

• 保存注意事项: Lachrymatory
• TSCA收录: false

产品相关信息

• 纯度: 98%