trimethyl(phenyl)silane

• ChemBase编号: 111864
• 分子式: C9H14Si
• 平均质量: 150.29296
• 单一同位素质量: 150.08647698
• SMILES: C[Si](C)(C)c1ccccc1
• Canonical SMILES: C[Si](c1ccccc1)(C)C
• InChI: InChI=1S/C9H14Si/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3
• InChIKey: KXFSUVJPEQYUGN-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: trimethyl(phenyl)silane
• IUPAC传统名: silane, trimethyl phenyl
• 别名: 苯基三甲基硅烷; (三甲基硅基)苯; 苯基三甲基硅烷; 三甲基苯基硅烷; TRIMETHYLPHENYLSILANE; Trimethylphenylsilane; Phenyltrimethylsilane; (Trimethylsilyl)benzene; Phenyltrimethylsilane; Trimethyl(phenyl)silane

登记号

• CAS号: 768-32-1
• EC号: 212-192-5
• MDL号: MFCD00008271
• Beilstein号: 1855012
• PubChem SID: 24887434; 24851844; 162096880
• PubChem CID: 69849

理论计算性质

• 质子受体: 0
• 质子供体: 0
• LogD (pH = 5.5): 3.6312
• LogD (pH = 7.4): 3.6312
• Log P: 3.6312
• 摩尔折射率: 42.1216 cm^3
• 极化性: 18.83388 Å^3
• 极化表面积: 0.0 Å^2
• 可自由旋转的化学键: 1
• 里宾斯基五规则: true

分子性质

理化性质

• 沸点: 168-170 °C(lit.); 169-170°C
• 闪点: 104 °F; 40 °C; 40°C(104°F)
• 密度: 0.871; 0.873 g/mL at 25 °C(lit.)
• 折射率: 1.4900; n20/D 1.491; n20/D 1.491(lit.)

安全信息

• 欧盟危险性物质标志: 刺激性(Irritant) (Xi)
• 联合国危险货物编号: 1993; UN1993
• 德国WGK号: 3
• 联合国危险货物等级: 3
• 联合国危险货物包装类别(PG): 3; III
• 危险公开号: 10-36/38; 10-41
• 安全公开号: 16-26-36/39; 23-26-37
• TSCA收录: 是
• GHS危险品标识: GHS02; GHS05; GHS07
• GHS警示词: Danger
• GHS危险声明: H226-H315-H319; H226-H318-H413
• GHS警示性声明: P261-P280G-P305+P351+P338; P280-P305 + P351 + P338
• 个人保护装置: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1993 3/PG 3

产品相关信息

• 纯度: ≥98.0% (GC); 99%
• 级别: purum
• 线性分子式: C6H5Si(CH3)3

详细说明

MP Biomedicals - 05221421

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 197734

包装
25 g in glass bottle

参考文献

• Reagent, in combination with iodine, for cleavage of esters and ethers, cf Iodotrimethylsilane, A12902. Reported to be superior to TMS iodide for the cleavage of aryl ethers: Synthesis, 417 (1977).