化工社化工社 化学情報印刷レポート · 研究参考用
1-アミノデカン
1-アミノデカン · デカン-1-アミン · n-デシルアミン · 1-デカンアミン · デシルアミン · １ーデカンアミン · アルカン-1-アミン（C＝8，10，12，14，16，18、直鎖型）、（Z）-オクタデカ-9-エン-1-アミン又は（9Z，12Z）-オクタデカ-9，12-ジエン-1-アミン · 1-デシルアミン
識別子と物理属性
| CAS No. | 2016-57-1 |
|---|---|
| 分子式 | C10H23N |
| 平均分子量 | 157.3 g/mol |
| 単同位体質量 | 157.18304974 g/mol |
| SMILES | CCCCCCCCCCN |
| InChIKey | MHZGKXUYDGKKIU-UHFFFAOYSA-N |
| PubChem CID | 8916 |
| ChEMBL | CHEMBL109819 |
| ChEBI | CHEBI:166481 |
| EC No. | 217-957-7 |
| DTXSID | DTXSID2022171 |
| 現地名 | 1-アミノデカン |
化学・物理的性質
| XLogP | 4.2 |
|---|---|
| 極性表面積 | 26 |
| 水素結合供与体数 | 1 |
| 水素結合受容体数 | 1 |
| 回転可能結合数 | 8 |
| 重原子数 | 11 |
| 形式電荷 | 0 |
| 複雑度 | 61.9 |
| 物質分類 | Nitrogen Compounds -> Amines, AliphaticIndustrial compound |
| SpringerMaterials Properties | Boiling point |
| LogP（分配係数） | log Kow = 1.92 |
| 臭い | Amine odor |
| 密度 | 0.730.787 g/mL at 25 °C(lit.) |
| Color/Form | LiquidWater-white liquid |
| 溶解度 | In water, 5.5X10+2 mg/L at 25 °Cクロロホルム、酢酸エチル |
| 沸点 | 220.5 °C216-218 °C(lit.) |
| 融点 | 17 °C12-14 °C(lit.) |
| 蒸気密度 | 5.5 (Air = 1) |
| 蒸気圧 | 0.1 [mmHg]0.1 mm Hg at 25 °C |
| 屈折率 | Index of refraction = 1.437 at 20 °Cn20/D 1.436(lit.) |
| 引火点 | 186 °F |
| 貯蔵条件 | room temp |
| 外観・状態 | 液体 |
| pKa（酸解離定数） | 10.64(at 25℃) |
| 色 | 無色透明～黄色または茶色 |
| BRN | 1735220 |
| ヘンリー定数 | 2.6×10-1 mol/(m3Pa) at 25℃, Duchowicz et al. (2020) |
| 安定性 | 安定。強力な酸化剤、酸、酸塩化物、酸無水物とは相容れない。空気中の二酸化炭素を吸収できます。 |
| InChI | 1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3 |
| InChIKey | MHZGKXUYDGKKIU-UHFFFAOYSA-N |
| SMILES | CCCCCCCCCCN |
| CAS データベース | 2016-57-1(CAS DataBase Reference) |
| NISTの化学物質情報 | 1-Decanamine(2016-57-1) |
| EPAの化学物質情報 | Decylamine (2016-57-1) |
化学的特性
It is a clear, colorless, flammable, liquid with a ammonia odor. Slightly soluble in water, easily soluble in ethanol, ether, acetone, benzene and chloroform.
安全性と法規制
| GHS 分類 | DangerH301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]P260, P262, P264, P270, P273, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P361+P364, P363, P391, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 48 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 規制情報 | Chemical: 1-Decanamine |
| 有害性の概要 | An irritant[Hawley] A corrosive substance that can cause injury to the skin, eyes, and respiratory tractInhalation may cause chemical pneumonitis and pulmonary edemaReadily absorbed through skin[Aldrich MSDS] |
| Hazard Classes and Categories | Acute Tox. 3 (100%) |
| 処分方法 | SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational exposure or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air qualitypotential migration in soil or watereffects on animal, aquatic, and plant lifeand conformance with environmental and public health regulations. |
| 環境中動態 | TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 260(SRC), determined from a log Kow of 1.92(2) and a regression-derived equation(3), indicates that decylamine is expected to have moderate mobility in soil(SRC). Volatilization of decylamine from moist soil surfaces is expected to be an important fate process(SRC) given a Henry's Law constant of 6.69X10-5 atm-cu m/mole(4). However, a pKa of 10.6(5) indicates decylamine will exist almost entirely in the ionized form at pH values of 5 to 9 and therefore volatilization from moist soil surfaces is not expected to be an important fate process. Decylamine is not expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.1 mm Hg(6). Decylamine was fully degraded within 9 hours when placed in a inoculum of bacteria grown on pure decylamine(7). When decylamine was absorbed into clay and placed in the same inoculum about 50% degradation was observed after 24 hours(7). |
用途
用途
有機合成原料。
使用
1-Decylamine is a intermediate forming the phosphatidylcholine-decylamine liposomal membranes.
一般的な説明
Decylamine is a hydrophobic long alkylated cationic ammonium that is used to modify the polarity of reversed phases on octadecylsilyl (ODS) gels.