化工社化工社 化学情報印刷レポート · 研究参考用
トリメチルフェニルシラン
トリメチルフェニルシラン · トリメチルシリルベンゼン · トリメチル(フェニル)シラン · (トリメチルシリル)ベンゼン · フェニルトリメチルシラン · (フェニル)トリメチルシラン · フェニルトリメチルシラン, 99% · DK899
識別子と物理属性
| CAS No. | 768-32-1 |
|---|---|
| 分子式 | C9H14Si |
| 平均分子量 | 150.29 g/mol |
| 単同位体質量 | 150.08647698 g/mol |
| SMILES | C[Si](C)(C)c1ccccc1 |
| InChIKey | KXFSUVJPEQYUGN-UHFFFAOYSA-N |
| PubChem CID | 69849 |
| EC No. | 212-192-5 |
| DTXSID | DTXSID6061109 |
| 現地名 | トリメチルフェニルシラン |
化学・物理的性質
| 極性表面積 | 0 |
|---|---|
| 水素結合供与体数 | 0 |
| 水素結合受容体数 | 0 |
| 回転可能結合数 | 1 |
| 重原子数 | 10 |
| 形式電荷 | 0 |
| 複雑度 | 95 |
| 融点 | 166-169 °C |
| 沸点 | 168-170 °C(lit.) |
| 密度 | 0.873 g/mL at 25 °C(lit.) |
| 屈折率 | n20/D 1.491(lit.) |
| 引火点 | 112 °F |
| 貯蔵条件 | Inert atmosphere,Room Temperature |
| 外観・状態 | clear liquid |
| 色 | Colorless to Almost colorless |
| 比重 | 0.873 |
| 溶解度 | 水と混和しないか、または混合しにくい。 |
| BRN | 1855012 |
| InChI | 1S/C9H14Si/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3 |
| InChIKey | KXFSUVJPEQYUGN-UHFFFAOYSA-N |
| SMILES | C[Si](C)(C)c1ccccc1 |
| CAS データベース | 768-32-1(CAS DataBase Reference) |
| NISTの化学物質情報 | Silane, trimethylphenyl-(768-32-1) |
| EPAの化学物質情報 | Silane, trimethylphenyl- (768-32-1) |
化学的特性
CLEAR COLOURLESS TO GREEN LIQUID
安全性と法規制
| GHS 分類 | DangerH226 (97.8%): Flammable liquid and vapor [Warning Flammable liquids]H315 (13%): Causes skin irritation [Warning Skin corrosion/irritation]H318 (84.8%): Causes serious eye damage [Danger Serious eye damage/eye irritation]H319 (13%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H413 (84.8%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]P210, P233, P240, P241, P242, P243, P264, P264+P265, P273, P280, P302+P352, P303+P361+P353, P305+P351+P338, P305+P354+P338, P317, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Flam. Liq. 3 (97.8%)Skin Irrit. 2 (13%)Eye Dam. 1 (84.8%)Eye Irrit. 2 (13%)Aquatic Chronic 4 (84.8%) |
| 水環境危害等級（WGK） | 3 |
| TSCA 収載状態 | TSCA listed |
| 輸送番号（UN） | UN 1993 3/PG 3 |
| 税関コード | 29319090 |
| 危険文句（R） | 10-41-36/37/38 |
| 消防法 | 危-4-2-III |
| 危険表示 | Xi |
| 安全措置（S） | 16-26-36/39-37/39 |
| 危険等級 | 3Aquatic Chronic 4Eye Dam. 1Flam. Liq. 3 |
| 包装等級 | III |
| 貯蔵分類 | 3 - Flammable liquids |
用途
使用
It is employed as intermediate for pharmaceutical and organic synthesis.
製法・合成法
純化方法
Fractionally distil the silane at atmospheric or reduced pressure (Podbielniak column p 11) and estimate it by GC with a column packed with Silicone Fluid No 710 on Chromosorb P support. [Gilman et al. J Org Chem 18 1743 1953, Maienthal et al. J Am Chem Soc 76 6392 1954, House & Respess J Organomet Chem 4 95 1965, Roberts et al. J Am Chem Soc 71 2923 1949, Freiser et al. J Am Chem Soc 75 2821 1953, Beilstein 16 I 525, 16 II 605, 16 III 1198, 16 IV 1361.]