trichloro(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)silane

• ChemBase编号: 100436
• 分子式: C12H4Cl3F21Si
• 平均质量: 681.5711272
• 单一同位素质量: 679.88125232
• SMILES: [Si](CCC(C(F)(F)C(F)(F)C(F)(F)C(C(F)(F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(Cl)(Cl)Cl
• Canonical SMILES: Cl[Si](CCC(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)(Cl)Cl
• InChI: InChI=1S/C12H4Cl3F21Si/c13-37(14,15)2-1-3(16,17)4(18,19)5(20,21)6(22,23)7(24,25)8(26,27)9(28,29)10(30,31)11(32,33)12(34,35)36/h1-2H2
• InChIKey: ZFUVZJADECZZMS-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: trichloro(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)silane
• IUPAC传统名: trichloro(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)silane
• 别名: 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-二十一氟十二烷基三氯硅烷; 1H,1H,2H,2H-全氟十二烷基三氯硅烷; 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-Heneicosafluorododecyltrichlorosilane; 1H,1H,2H,2H-Perfluorododecyltrichlorosilane; Henicosafluorododecyltrichlorosilane; 1-[2-(Trichlorosilyl)ethyl]perfluorodecane; [2-(Perfluorodec-1-yl)ethyl]trichlorosilane 97%

登记号

• CAS号: 102488-49-3
• MDL号: MFCD07368770
• PubChem SID: 162086540
• PubChem CID: 2782914

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 10.6574
• LogD (pH = 7.4): 10.6574
• Log P: 10.6574
• 摩尔折射率: 75.7719 cm^3
• 极化性: 31.551668 Å^3
• 极化表面积: 0.0 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

• 熔点: 50-55 °C; 50-55°C
• 沸点: 113-114°C/4mm
• 闪点: >110 °C; >110°C; >230 °F

安全信息

• 保存注意事项: Corrosive/Harmful/Moisture Sensitive/Store under Argon
• 欧盟危险性物质标志: 腐蚀性(Corrosive) (C)
• 德国WGK号: 3
• 危险公开号: 14-34
• 安全公开号: 22-26-27-36/37/39-45
• GHS危险品标识: GHS05
• GHS警示词: Danger
• GHS危险声明: H314
• GHS警示性声明: P280-P305 + P351 + P338-P310
• 欧盟补充危害声明: Reacts violently with water.

产品相关信息

• 纯度: 97%
• 线性分子式: CF3(CF2)9CH2CH2SiCl3

详细说明

Sigma Aldrich - 729965

包装
1, 5 g in glass bottle