2-フルオロエチルアミン塩酸塩

Ethanamine, 2-fluoro-, hydrochloride

HCID 9995CAS 460-08-2

部分構造検索類似構造を探す

基本情報

標準SMILES: Cl.NCCF
InChIKey: YRRZGBOZBIVMJT-UHFFFAOYSA-N
分子式: C2H7ClFN
平均分子量: 99.53 g/mol
単同位体質量: 99.02510512

名称と識別子

優先名称: Ethanamine, 2-fluoro-, hydrochloride
IUPAC: 2-fluoroethanamine;hydrochloride
現地名: 2-フルオロエチルアミン塩酸塩
英語名: 2-Fluoroethylamine hydrochloride
分子式: C2H7ClFN
分子量: 99.54

名称と別名

460-08-22-Fluoroethanamine hydrochlorideEthanamine, 2-fluoro-, hydrochloridebeta-Fluoroethylamine hydrochlorideEINECS 207-302-3NSC 88721AI3-52233ETHYLAMINE, 2-FLUORO-, HYDROCHLORIDEEthanamine, 2-fluoro-, hydrochloride (9CI)DTXSID40196678RefChem:138023DTXCID80119169

名称をさらに表示

2-フルオロエチルアミン塩酸塩2-フルオロエタンアミン塩酸塩2-フルオロエチルアミン塩酸塩2-フルオロエタンアミン・塩酸塩(2-フルオロエチル)アミニウム・クロリド(2-フルオロエチル)アンモニウム・クロリド(2-フルオロエチル)アンモニウム=クロリドTIMTEC-BB SBB0043692-FluoroethylaMine, HCl2-FluoroethanaMine, HCl2-Fluoroethylammonium chloride2-FluorethylaMin hydrochloride2-FLUORETHYLAMINEHYDROCHLORIDE2-FLUORETHANAMINEHYDROCHLORIDE2-fluoroethanaminehydrochloride2-fluoro-ethanaminhydrochloride

2-Fluoroethylamine hydrochloride2-fluoroethan-1-amine hydrochloride2-fluoroethanamine;hydrochlorideMFCD00008161C2H7ClFN2-fluoroethanaminium chloridefluoroethyl amine hydrochloride2-fluoroethanamine hydrochloric acid

データベース識別子

CAS: 460-08-2
PubChem CID: 9995
DTXSID: DTXSID40196678
EC Number: 207-302-3

物性

構造計算による物性

極性表面積: 26 Å²
水素結合供与体数: 2
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 5
形式電荷: 0
複雑度: 10

物理化学的性質

融点: 99 · 99-103 °C(lit.)
貯蔵温度: Inert atmosphere,Room Temperature
水溶解度: Soluble in water
外見: powder to crystal
色: White to Light yellow to Light orange
InChI: InChI=1S/C2H6FN.ClH/c3-1-2-4;/h1-2,4H2;1H
InChIKey: YRRZGBOZBIVMJT-UHFFFAOYSA-N
SMILES: C(N)CF.Cl

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)

Aggregated GHS information provided per 5 reports by companies from 4 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 CategoriesSkin Irrit. 2 (100%)

安全データ

wgk: 3
rtecs: KR7570000
hs_code: 2921199990
hazard_code: Xi
hazard_class: IRRITANT, HYGROSCOPIC
ストレージクラス: 11 - Combustible Solids

化学と産業

応用分野 · 2 件

使用2-Fluoroethylamine hydrochloride may be used in the synthesis of the following:2-fluoroethylisocyanate1,3-bis-(2-fluoroethyl) urea (BFU)N-2-fluoroethylmaleimide[Cu4(O)(Ln)2(CH3COO)4] where HL= 4-methyl-2,6-bis(2-fluoroethyliminomethyl) phenol1-O-(4-(2-fluoroethyl-carbamoyloxymethyl)-2-nitrophenyl)-O-β-D-glucopyronuronate (FEAnGA)

一般的な説明2-Fluoroethylamine hydrochloride is a fluorinated alkylammonium salt. Studies suggest that adding a fluorine atom to it leads to double gauche effect in the resulting 2,2-difluoroethylamine chloride. Microwave spectral studies for 2-fluoroethylamine has been conducted.