N,N-ジエチル-N'-メチルエチレンジアミン

1,2-Ethanediamine, N1,N1-diethyl-N2-methyl-

HCID 66034CAS 104-79-0

部分構造検索類似構造を探す

基本情報

標準SMILES: CCN(CC)CCNC
InChIKey: MKDYQLJYEBWUIG-UHFFFAOYSA-N
分子式: C7H18N2
平均分子量: 130.23 g/mol
単同位体質量: 130.14699858

名称と識別子

優先名称: 1,2-Ethanediamine, N1,N1-diethyl-N2-methyl-
IUPAC: N',N'-diethyl-N-methylethane-1,2-diamine
現地名: N,N-ジエチル-N'-メチルエチレンジアミン
英語名: N,N-Diethyl-N'-methylethylenediamine
分子式: C7H18N2
分子量: 130.23

名称と別名

104-79-0N,N-Diethyl-N'-methylethylenediamine2-(Diethylamino)-N-methylethylamineDiethyl(2-methylaminoethyl)amineEthylenediamine, N,N-diethyl-N'-methyl-(2-(Diethylamino)ethyl)methylamine[2-(Diethylamino)ethyl]methylamineEINECS 203-238-51,2-Ethanediamine, N1,N1-diethyl-N2-methyl-NSC 27480RefChem:411915Ethylenediamine, N,N-diethyl-N'-methyl-(8CI)

名称をさらに表示

N,N-ジエチル-N'-メチルエチレンジアミンN,N-ジエチル-N'-メチルエタン-1,2-ジアミンN,N-ジエチル-N'-メチル-1,2-エタンジアミンN,N-ジエチル-N′-メチルエチレンジアミンN,N-Diethyl-N'-methylenediamineN, N-Diethyl-N-methylethylendiaminen,n-diethyl-n’-methyl-2-ethanediamineN,N-Diethyl-N'-methylethane-1,2-diamine

203-238-5N1,N1-Diethyl-N2-methylethane-1,2-diamine1,2-Ethanediamine, N,N-diethyl-N'-methyl-diethyl[2-(methylamino)ethyl]amineN',N'-diethyl-N-methylethane-1,2-diamineMFCD00009053E57SYE7WSPN,N-Diethyl-N/'-methylethylenediamine

データベース識別子

CAS: 104-79-0
PubChem CID: 66034
DTXSID: DTXSID2059304
UNII: E57SYE7WSP
EC Number: 203-238-5
Nikkaji: J25.730C

物性

構造計算による物性

XLogP: 0.6
極性表面積: 15.3 Å²
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: 5
重原子数: 9
形式電荷: 0
複雑度: 50.9

物理化学的性質

融点: 28.9 °C · 28.9°C (estimate)
沸点: 157 · 157-160 °C(lit.)
比重(密度): 0.805 g/mL · 0.805 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.4296(lit.)
闪点: 106 °F · 106 °F
貯蔵温度: Flammables area
溶解性: Chloroform (Soluble), Methanol (Soluble)
酸解離定数(Pka): 10.49 · 10.49±0.10(Predicted)
外見: clear liquid
色: Colorless to Almost colorless
InChI: 1S/C7H18N2/c1-4-9(5-2)7-6-8-3/h8H,4-7H2,1-3H3
InChIKey: MKDYQLJYEBWUIG-UHFFFAOYSA-N
SMILES: CCN(CC)CCNC
CAS データベース: 104 · 104-79-0(CAS DataBase Reference)
EPAの化学物質情報: 1 · 1,2-Ethanediamine, N,N-diethyl-N'-methyl- (104-79-0)

化学的性質

化学的特性CLEAR COLORLESS LIQUID

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

安全データ

wgk: 3
tsca: TSCA listed
ridadr: UN 2734 8/PG 2
hs_code: 29212900
risk_code: 10-34
消防法: 危-4-2-III
hazard_code: C
safety_code: 16-26-27-36/37/39-45
hazard_class: 8
packing_group: II
Hazard Classifications: Flam. Liq. 3Skin Corr. 1B
ストレージクラス: 3 - Flammable liquids

化学と産業

用途と製造

General Manufacturing Information1,2-Ethanediamine, N1,N1-diethyl-N2-methyl-: INACTIVE

応用分野

使用N,N-Diethyl-N′-methylethylenediamine was used as a derivatization agent in the quantitative determination of isocyanates by capillary electrophoresis with tris(2,2′-bipyridyl)ruthenium(II) electrochemiluminescence (ECL).

一般的な説明The Michael addition of N,N-Diethyl-N′-methylethylenediamine to nocathiacin was studied.