Chloride 2-chloropyridinium 1-oxide

HCID 88478CAS 20295-64-1

基本情報

標準SMILES: Cl.[O-][n+]1ccccc1Cl
InChIKey: GRZNODNSNCXOHE-UHFFFAOYSA-N
分子式: C5H5Cl2NO
平均分子量: 166 g/mol
単同位体質量: 164.97481914

名称と識別子

優先名称: Chloride 2-chloropyridinium 1-oxide
IUPAC: 2-chloro-1-oxidopyridin-1-ium;hydrochloride

名称と別名

DTXSID10174180Chloride 2-chloropyridinium 1-oxideEINECS 243-712-9RefChem:575629DTXCID2096671NSC 352281243-712-920295-64-12-Chloropyridine N-oxide hydrochloride2-Chloropyridine 1-oxide hydrochloride2-Chloropyridine-N-oxide hydrochloridePyridine, 2-chloro-, 1-oxide, hydrochloride (1:1)

名称をさらに表示

2-Chloropyridine N-oxide HCl2-chloro-1-oxidopyridin-1-ium;hydrochlorideMFCD00012805Pyridine, 2-chloro-, 1-oxide, hydrochloride2-chloro-1-oxidopyridin-1-ium hydrochloride2-Chloro-1-oxido-pyridin-1-ium hydrochloride2-chloropyridine N-oxide.HClSCHEMBL852482

データベース識別子

CAS: 20295-64-1
PubChem CID: 88478
DTXSID: DTXSID10174180
EC Number: 243-712-9

物性

構造計算による物性

極性表面積: 25.5 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: 0
重原子数: 9
形式電荷: 0
複雑度: 78.8

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 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.