基本情報
- CAS
140-82-9- 標準SMILES
CCN(CC)CCOCCO- InChIKey
VKBVRNHODPFVHK-UHFFFAOYSA-N- 分子式
- C8H19NO2
- 平均分子量
- 161.24 g/mol
- 単同位体質量
- 161.14157885
概要
Diethylaminoethoxyethanol appears as a colorless liquid with an amine-like odor. Slightly less dense than water and slightly soluble in water. May emit toxic oxides of nitrogen when heated to high temperatures May cause irritate the skin, eyes, and mucous membranes. May be toxic by ingestion. Used to make other chemicals.
名称と識別子
- 優先名称
- Diethylaminoethoxyethanol
- IUPAC
- 2-[2-(diethylamino)ethoxy]ethanol
- 現地名
- 2-(2-ジエチルアミノエトキシ)エタノール
- 英語名
- 6-Ethyl-3-oxa-6-azaoctanol
- 分子式
- C8H19NO2
- 分子量
- 161.24
名称と別名
2-(2-(Diethylamino)ethoxy)ethanol2-[2-(Diethylamino)ethoxy]ethanolDiethylaminoethoxyethanolEthanol, 2-[2-(diethylamino)ethoxy]-2-(2-Diethylaminoethoxy)-ethanol2-(beta-(Diethylamino)ethoxy)ethanolNSC 163322EINECS 205-436-7N,N-DiethylethoxyethanolamineEthanol, 2-(2-(diethylamino)ethoxy)-2-.beta.-DiethylaminoethoxyethanolDiethyl[2-(2-hydroxyethoxy)ethyl]amine
名称をさらに表示
2-(2-ジエチルアミノエトキシ)エタノール2-[2-(ジエチルアミノ)エトキシ]エタノールエチレングリコールモノ(2-ジエチルアミノエチル)エーテルエチレングリコールモノ[2-(ジエチルアミノ)エチル]エーテル2-[2-(ジエチルアミノ)エトキシ]エタン-1-オール2-2-(Diethylamine)ethoxylethanolDEAEE2-2-(Diethylamine)etButamirate Impurity 4Butamirate Impurity 5Butamirate Impurity AOxeladin EP Impurity A2-(2-Diethylaminoethoxy)
2-[2-(N,N-Diethylamino)ethoxy]ethanolDTXSID9059701EC 205-436-7.beta.-(Diethylamino ethoxy)ethanol2-(2-(N,N-DIETHYLAMINO)ETHOXY)ETHANOLDIETHYL(2-(2-HYDROXYETHOXY)ETHYL)AMINEDIETHYLAMINOETHOXYETHANOL, (FLAMMABLE LIQUID LABEL)DIETHYLAMINOETHOXYETHANOL, [FLAMMABLE LIQUID LABEL]
物性
構造計算による物性
- XLogP
- 0.2
- 極性表面積
- 32.7 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 7
- 重原子数
- 11
- 形式電荷
- 0
- 複雑度
- 74.5
実験および物理化学的性質
SpringerMaterials PropertiesViscosity
Physical Description
Diethylaminoethoxyethanol appears as a colorless liquid with an amine-like odor. Slightly less dense than water and slightly soluble in water. May emit toxic oxides of nitrogen when heated to high temperatures May cause irritate the skin, eyes, and mucous membranes. May be toxic by ingestion. Used to make other chemicals.
物理化学的性質
- 沸点
- 101 °C · 101°C 1mm
- 比重(密度)
- 0 · 0,94 g/cm3
- 屈折率
- 1.447 · 1.4470-1.4500
- 闪点
- 96 °C · 96°C
- 貯蔵温度
- 2 · Inert atmosphere,2-8°C
- 溶解性
- Chloroform (Slightly), Methanol (Slightly)
- 酸解離定数(Pka)
- 14.39 · 14.39±0.10(Predicted)
- 外見
- clear liquid
- 色
- Colorless to Light orange to Yellow
- InChI
- InChI=1S/C8H19NO2/c1-3-9(4-2)5-7-11-8-6-10/h10H,3-8H2,1-2H3
- InChIKey
- VKBVRNHODPFVHK-UHFFFAOYSA-N
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Danger
H312 (77.2%): Harmful in contact with skin [Warning Acute toxicity, dermal]
P260, P264, P264+P265, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 57 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory InformationREACH registered substance: 2-[2-(diethylamino)ethoxy]ethanol (EC: 205-436-7)
DOT LabelFlammable Liquid
Fire HazardsExcerpt from ERG Guide 127 [Flammable Liquids (Water-Miscible)]:
Health HazardsExcerpt from ERG Guide 127 [Flammable Liquids (Water-Miscible)]:
Reactive GroupAlcohols and Polyols
Reactivity AlertsHighly Flammable
Reactivity Profile
DIETHYLAMINOETHOXYETHANOL is an amine and alcohol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides.
Air and Water Reactions
化学と産業
用途と製造
General Manufacturing InformationEthanol, 2-[2-(diethylamino)ethoxy]-: ACTIVE
応用分野
使用A metabolite of Butamirate; also a degradation product of Oxeladin citrate (OL) and Oxybutynin hydrochloride (OB).
一般的な説明A colorless liquid with an amine-like odor. Slightly less dense than water and slightly soluble in water. Flash point below 141°F. May emit toxic oxides of nitrogen when heated to high temperatures May cause irritate the skin, eyes, and mucous membranes. May be toxic by ingestion. Used to make other chemicals.
上流・下流製品情報
上流原料
サプライヤー100 社
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
関連反応
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化合物ノート
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