2-クロロ-N-メチルエタンアミン塩酸塩

Ethanamine, 2-chloro-N-methyl-, hydrochloride (1:1)

HCID 3028223

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 4535-90-4
標準SMILES: CNCCCl.Cl
InChIKey: FGSHJLJPYBUBHO-UHFFFAOYSA-N
分子式: C3H9Cl2N
平均分子量: 130.01 g/mol
単同位体質量: 129.01120465

名称と識別子

優先名称: Ethanamine, 2-chloro-N-methyl-, hydrochloride (1:1)
IUPAC: 2-chloro-N-methylethanamine;hydrochloride
現地名: 2-クロロ-N-メチルエタンアミン塩酸塩
英語名: 2-Chloro-N-MethylethanaMine Hydrochloride
分子式: C3H9Cl2N
分子量: 130.01626

名称と別名

4535-90-4Ethanamine, 2-chloro-N-methyl-, hydrochlorideEthanamine, 2-chloro-N-methyl-, hydrochloride (1:1)2-Chloroethyl(methyl)ammonium chlorideDTXSID80884087ETHYLAMINE, 2-CHLORO-N-METHYL-, HYDROCHLORIDEEINECS 224-882-3Methyl-beta-chloroethylamine hydrochlorideN-Methyl-2-chloroethylamine, hydrochlorideRefChem:591417DTXCID301023557224-882-3

名称をさらに表示

2-クロロ-N-メチルエタンアミン塩酸塩(2-Chloroethyl)-methylamine HCl2-Chloroethyl-Methyl-Azanium Chloride2-Chloro-N-MethylethanaMiniuM chloride2-chloro-n-methyl-ethylaminhydrochloride2-chloro-n-methyl-ethanaminhydrochloride2-Chloro-N-MethylethylaMine Hydrochloride

2-chloro-N-methylethanamine hydrochloride2-methylaminoethyl chloride hydrochlorideMFCD000505172-Chloro-N-methylethanamine HCl(2-CHLOROETHYL)(METHYL)AMINE HYDROCHLORIDE2-Methylaminoethyl chloride HCl(2-chloroethyl)methylamine hydrochlorideN-Methyl-2-chloroethylamine Hydrochloride

データベース識別子

CAS: 4535-90-4
PubChem CID: 3028223
DTXSID: DTXSID80884087
UNII: U4BX3FE3GL
EC Number: 224-882-3

物性

構造計算による物性

極性表面積: 12 Å²
水素結合供与体数: 2
水素結合受容体数: 1
回転可能結合数: 2
重原子数: 6
形式電荷: 0
複雑度: 16.4

物理化学的性質

融点: 89 °C · 89 °C
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2-8°C
外見: solid
色: White to off-white
InChI: InChI=1S/C3H8ClN.ClH/c1-5-3-2-4;/h5H,2-3H2,1H3;1H
InChIKey: FGSHJLJPYBUBHO-UHFFFAOYSA-N
SMILES: C(NC)CCl.Cl
EPAの化学物質情報: 2 · Ethanamine, 2-chloro-N-methyl-, hydrochloride (4535-90-4)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

安全データ

tsca: TSCA listed
hs_code: 2921199990

化学と産業

用途と製造

General Manufacturing InformationEthanamine, 2-chloro-N-methyl-, hydrochloride (1:1): INACTIVE

応用分野

使用2-Chloro-N-Methylethanamine Hydrochloride is an aminoalkoxyimino derivative used in the preparation of amino derivatives of B-homoandrostanes and B-heteroandrostanes for the treatment of cardiovascular disorders.