化工社化工社 化学情報印刷レポート · 研究参考用
ジメチルミリスチルアミンN-オキシド
ミリスチルジメチルアミンオキシド · テトラデシルジメチルアミンN-オキシド · ジメチルミリスチルアミンN-オキシド · N-テトラデシル-N,N-ジメチルアミンオキシド · テトラデシルジメチルアミンオキシド · ミリスチルジメチルアミンN-オキシド · N,N-ジメチルテトラデカン-1-アミンオキシド · N,N-ジメチルテトラデカン-1-アミンN-オキシド

識別子と物理属性
| CAS No. | 3332-27-2 |
|---|---|
| 分子式 | C16H35NO |
| 平均分子量 | 257.45 g/mol |
| 単同位体質量 | 257.27186474 g/mol |
| SMILES | CCCCCCCCCCCCCC[N+](C)(C)[O-] |
| InChIKey | ONHFWHCMZAJCFB-UHFFFAOYSA-N |
| PubChem CID | 18739 |
| ChEMBL | CHEMBL1782221 |
| EC No. | 222-059-3 |
| DTXSID | DTXSID2029660 |
| 現地名 | ジメチルミリスチルアミンN-オキシド |
化学・物理的性質
| XLogP | 6.4 |
|---|---|
| 極性表面積 | 18.1 |
| 水素結合供与体数 | 0 |
| 水素結合受容体数 | 1 |
| 回転可能結合数 | 13 |
| 重原子数 | 18 |
| 形式電荷 | 0 |
| 複雑度 | 168 |
| Physical Description | CBILiquid |
| 密度 | 0.716[at 20℃] |
| 蒸気圧 | 0Pa at 25℃ |
| 引火点 | >100℃ |
| 貯蔵条件 | 15-25°C |
| 溶解度 | H2O: 可溶1% (w/v)、透明、無色409.5g/L at 20℃ |
| pKa(酸解離定数) | 4.01[at 20 ℃] |
| 外観・状態 | Solid |
| 色 | White to off-white |
| pH | 5-9 (1% (w/v) in H2O) |
| BRN | 4245192 |
| 化粧品成分の機能 | 界面活性剤 - ハイドロトロープクレンジングヘアコンディショニング界面活性剤 - 乳化剤界面活性剤 - 泡立ち促進剤帯電防止界面活性剤 - 洗浄 |
| InChI | InChI=1S/C16H35NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)18/h4-16H2,1-3H3 |
| InChIKey | ONHFWHCMZAJCFB-UHFFFAOYSA-N |
| SMILES | C([N+]([O-])(C)C)CCCCCCCCCCCCC |
| LogP(分配係数) | 2.7 at 20℃ |
| EPAの化学物質情報 | N,N-Dimethylmyristylamine N-oxide (3332-27-2) |
| Absorption | ≤0.06 at 280nm≤0.08 at 260nm |
安全性と法規制
| GHS 分類 | DangerH302 (78.2%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (95.5%): Causes skin irritation [Warning Skin corrosion/irritation]H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]H400 (92.2%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]H410 (14.2%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]H411 (10.4%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]H412 (18.6%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P264, P264+P265, P270, P273, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 950 reports by companies from 19 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 | Chemical: 1-Tetradecanamine, N,N-dimethyl-, N-oxide1-Tetradecanamine, N,N-dimethyl-, N-oxide is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Tetradecanamine, N,N-dimethyl-, N-oxide are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)Status: Active Update: 20-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/146771-Tetradecanamine, N,N-dimethyl-, N-oxide: Does not have an individual approval but may be used under an appropriate group standard |
| EPA Safer Chemical | Chemical: N,N-Dimethyl-1-tetradecanamine-N-oxideGreen circle - The chemical has been verified to be of low concern based on experimental and modeled data. |
| Hazard Classes and Categories | Acute Tox. 4 (78.2%)Skin Irrit. 2 (95.5%)Eye Dam. 1 (100%)Aquatic Acute 1 (92.2%)Aquatic Chronic 1 (14.2%)Aquatic Chronic 2 (10.4%)Aquatic Chronic 3 (18.6%)Hazardous to the aquatic environment (Acute) - Category 1Hazardous to the aquatic environment (Long-term) - Category 1 |
| 水環境危害等級(WGK) | 2 |
| TSCA 収載状態 | TSCA listed |
| 危険文句(R) | 38-41 |
| 化審法 | 優先評価化学物質 |
| 危険表示 | Xi |
| 安全措置(S) | 26-39 |
| 危険等級 | Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 2Eye Dam. 1Skin Irrit. 2 |
| 貯蔵分類 | 11 - Combustible Solids |
用途
用途
界面活性剤原料