化工社化工社 化学情報印刷レポート · 研究参考用
エチレングリコールモノ-tert-ブチルエーテル
エチレングリコールモノ-tert-ブチルエーテル · エチレングリコールモノ-t-ブチルエーテル · 2-(tert-ブトキシ)エタノール · tert-ブチルセロソルブ · 2-tert-ブチルオキシエタノール · 2-(1,1-ジメチルエトキシ)エタノール · スワソルブETB · 2-tert-ブトキシエタノール
識別子と物理属性
| CAS No. | 7580-85-0 |
|---|---|
| 分子式 | C6H14O2 |
| 平均分子量 | 118.17 g/mol |
| 単同位体質量 | 118.09937969 g/mol |
| SMILES | CC(C)(C)OCCO |
| InChIKey | BDLXTDLGTWNUFM-UHFFFAOYSA-N |
| PubChem CID | 24232 |
| EC No. | 456-140-1 |
| DTXSID | DTXSID4073384 |
| 現地名 | エチレングリコールモノ-tert-ブチルエーテル |
化学・物理的性質
| XLogP | 0.2 |
|---|---|
| 極性表面積 | 29.5 |
| 水素結合供与体数 | 1 |
| 水素結合受容体数 | 2 |
| 回転可能結合数 | 3 |
| 重原子数 | 8 |
| 形式電荷 | 0 |
| 複雑度 | 54 |
| 沸点 | 152 °C |
| 密度 | 0,9 g/cm3 |
| 屈折率 | 1.4160 to 1.4190 |
| 引火点 | 55°C |
| 貯蔵条件 | Sealed in dry,Room Temperature |
| 溶解度 | Completely miscible in water |
| 外観・状態 | clear liquid |
| pKa（酸解離定数） | 14.44±0.10(Predicted) |
| 色 | Colorless to Almost colorless |
| InChI | InChI=1S/C6H14O2/c1-6(2,3)8-5-4-7/h7H,4-5H2,1-3H3 |
| InChIKey | BDLXTDLGTWNUFM-UHFFFAOYSA-N |
| SMILES | C(O)COC(C)(C)C |
| CAS データベース | 7580-85-0 |
| EPAの化学物質情報 | Ethanol, 2-(1,1-dimethylethoxy)- (7580-85-0) |
化学的特性
Colorless liquid
安全性と法規制
| GHS 分類 | WarningH226 (71.4%): Flammable liquid and vapor [Warning Flammable liquids]H302 (28.6%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (42.9%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (42.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (42.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]H373 (28.6%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 7 reports by companies from 3 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. |
|---|---|
| 規制情報 | Status: Active Update: 11-10-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/30055Status: Active Update: 14-02-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/8735 |
| Hazard Classes and Categories | Flam. Liq. 3 (71.4%)Acute Tox. 4 (28.6%)Skin Irrit. 2 (42.9%)Eye Irrit. 2A (42.9%)STOT SE 3 (42.9%)STOT RE 2 (28.6%)Flam. Liq. 3 (100%)Acute Tox. 4 (100%)Skin Irrit. 2 (100%)Eye Dam. 1 (100%)Acute Tox. 3 (100%)STOT SE 3 (100%)STOT RE 1 (100%)Flammable liquids - Category 3Specific target organ toxicity - Single exposure - Category 3 (Narcotic effects) |
用途
用途
塗料?シンナー?印刷インキ溶剤
使用
2-(1,1-Dimethylethoxy)ethanol is used in the preparation of potent and selective NPY5 receptor antagonists. Also used in the synthesis of PDE5 inhibitors, used to block the degradative action of phosphodiesterase 5.