3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododec-1-ene

• ChemBase编号: 7721
• 分子式: C12H3F21
• 平均质量: 546.1186872
• 单一同位素质量: 545.98994272
• SMILES: C(C(C(C(C(C(C(C(C(C=C)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)(F)F
• Canonical SMILES: C=CC(C(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)(F)F
• InChI: InChI=1S/C12H3F21/c1-2-3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)11(29,30)12(31,32)33/h2H,1H2
• InChIKey: UCHSAVGOZUCXHC-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododec-1-ene
• IUPAC传统名: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododec-1-ene
• 别名: 1H,1H,2H-全氟-1-十二烯; 1H,1H,2H-Perfluoro-1-dodecene; 1H,1H,2H-Perfluoro-1-dodecene; (Perfluorodecyl)ethylene; 1H,1H,2H-Perfluorododec-1-ene 97%

登记号

• CAS号: 30389-25-4
• EC号: 250-173-3
• MDL号: MFCD00042346
• Beilstein号: 2493721
• PubChem SID: 160971028
• PubChem CID: 121692

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 8.163655
• LogD (pH = 7.4): 8.163655
• Log P: 8.163655
• 摩尔折射率: 58.5938 cm^3
• 极化性: 22.782454 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 10
• 里宾斯基五规则: false

分子性质

理化性质

• 沸点: 71-72°C/14mm; 71-72°C/14mm
• 闪点: none°C
• 密度: 1.711
• 折射率: 1.303; 1.3050

安全信息

• 保存注意事项: IRRITANT; Irritant
• TSCA收录: false; 否

产品相关信息

• 纯度: 97%