(1-ethynylcyclopropoxy)tris(propan-2-yl)silane

• ChemBase编号: 168787
• 分子式: C14H26OSi
• 平均质量: 238.44114
• 单一同位素质量: 238.17529198
• SMILES: C1(CC1)(C#C)O[Si](C(C)C)(C(C)C)C(C)C
• Canonical SMILES: CC([Si](C(C)C)(C(C)C)OC1(CC1)C#C)C
• InChI: InChI=1S/C14H26OSi/c1-8-14(9-10-14)15-16(11(2)3,12(4)5)13(6)7/h1,11-13H,9-10H2,2-7H3
• InChIKey: RCIKKDVQALCGEY-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: (1-ethynylcyclopropoxy)tris(propan-2-yl)silane
• IUPAC传统名: (1-ethynylcyclopropoxy)triisopropylsilane
• 别名: 1-(Triisopropylsilyloxy)cyclopropylacetylene; 1-Ethynyl-1-[[tris(1-methylethyl)silyl]oxy]cyclopropane; 1-Ethynyl-1-(triisopropylsilyloxy)cyclopropane

登记号

• PubChem SID: 162262919
• PubChem CID: 53434868

理论计算性质

• 质子受体: 1
• 质子供体: 0
• LogD (pH = 5.5): 4.0313
• LogD (pH = 7.4): 4.0313
• Log P: 4.0313
• 摩尔折射率: 66.4036 cm^3
• 极化性: 28.32116 Å^3
• 极化表面积: 9.23 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

• 溶解度: Dichloromethane; Ethyl Acetate; Methanol
• 外观: Oil