CAS 3747-74-8 2-(Chloromethyl)quinoline hydrochloride (HCID 3083823)

基本情報

CAS: 3747-74-8
標準SMILES: Cl.ClCc1ccc2ccccc2n1
InChIKey: WDETYCRYUBGKCE-UHFFFAOYSA-N
分子式: C10H9Cl2N
平均分子量: 214.09 g/mol
単同位体質量: 213.01120465

名称と識別子

優先名称: 2-(Chloromethyl)quinoline hydrochloride
IUPAC: 2-(chloromethyl)quinoline;hydrochloride
現地名: 2-クロロメチルキノリン塩酸塩
英語名: 2-(Chloromethyl)quinoline hydrochloride
分子式: C10H9Cl2N
分子量: 214.09

名称と別名

2-(Chloromethyl)quinoline hydrochloride3747-74-82-(Chloromethyl)quinoline HClEINECS 223-145-3NSC 72444DTXSID30190908RefChem:84644DTXCID30113399223-145-32-Chloromethylquinoline HydrochlorideMFCD000127342-(chloromethyl)quinoline;hydrochloride

名称をさらに表示

2-クロロメチルキノリン塩酸塩2-(クロロメチル)キノリン塩酸塩2‐(クロロメチル)キノリン塩酸塩2-クロロメチルキノリン・塩酸塩α-chloroquinaldine hydrochlorideà-chloroquinaldine hydrochlorideA-CHLOROQUINALDINE HYDROCHLORIDEALPHA-CHLOROQUINALDINE HYDROCHLORIDE2-ChloromethylquinolineHydrochloride>ALPHA-CHLOROQUINALDINE MONOHYDROCHLORIDE2-(Chloromethyl)quinoline hydrochloride,97%

2-(Chloromethyl)quinolinehydrochlorideQuinoline, 2-(chloromethyl)-, hydrochloride2-(Chloromethyl)quinoline Monohydrochloride; 2-Chloromethylchinoline Hydrochloride2-Chloromethylchinoline hydrochloride2-(chloromethyl)-quinoline hydrochloride2-(CHLOROMETHYL)QUINOLINE MONOHYDROCHLORIDESCHEMBL1898992-(chloromethyl)quinoline-HCl

データベース識別子

CAS: 3747-74-8
PubChem CID: 3083823
DTXSID: DTXSID30190908
EC Number: 223-145-3

物性

構造計算による物性

極性表面積: 12.9 Å²
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: 1
重原子数: 13
形式電荷: 0
複雑度: 149

物理化学的性質

融点: 183 · 183-187 °C(lit.)
貯蔵温度: Keep in dark place,Sealed in dry,Room Temperature
水溶解度: Soluble in water
外見: 粉
色: 淡い黄色からクリーム色または淡いピンク色
BRN: 3565832 · 3565832
InChI: InChI=1S/C10H8ClN.ClH/c11-7-9-6-5-8-3-1-2-4-10(8)12-9;/h1-6H,7H2;1H
InChIKey: WDETYCRYUBGKCE-UHFFFAOYSA-N
SMILES: C12C=CC=CC1=CC=C(CCl)N=2.Cl
CAS データベース: 3747 · 3747-74-8(CAS DataBase Reference)

化学的性質

化学的特性PALE YELLOW TO CREAM OR LIGHT PINK POWDER

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H302 (88.9%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 3 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 CategoriesAcute Tox. 4 (88.9%)

安全データ

F: 10
wgk: 3
hs_code: 29334900
risk_code: 22-38-41-43-36/37/38
hazard_code: Xn,Xi
safety_code: 26-36/37/39-24/25
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2Skin Sens. 1
ストレージクラス: 11 - Combustible Solids

化学と産業

応用分野 · 1 件

使用2-(Chloromethyl)quinoline Hydrochloride, is a substituted Quinoline building block for the synthesis of various pharmaceutical and biologically active compounds. It can also be used for the preparation of Quinoline-based fluorescent zinc sensors, used as fluorescent probes.