4-(2-chloroethyl)-1H-imidazole hydrochloride

HCID 178478570CAS 6429-10-3

基本情報

標準SMILES: Cl.ClCCc1c[nH]cn1
InChIKey: VLYMIZRIGGBHSH-UHFFFAOYSA-N
分子式: C5H8Cl2N2
平均分子量: 167.03 g/mol
単同位体質量: 166.0064537

名称と識別子

優先名称: 4-(2-chloroethyl)-1H-imidazole hydrochloride
IUPAC: 5-(2-chloroethyl)-1H-imidazole;hydrochloride
英語名: 4-(2-Chloro-ethyl)-1H-imidazole HCl
分子式: C5H8Cl2N2
分子量: 167.03642

名称と別名

4-(2-Chloroethyl)-1H-imidazole hydrochloride4-[2-chloroethyl]-1H-imidazole hydrochlorideRefChem:512349872-272-66429-10-35-(2-Chloroethyl)-1H-imidazole hydrochloride4-(2-chloroethyl)imidazole hydrochloride4-(2-Chloro-ethyl)-1H-imidazole HCL5-(2-chloroethyl)-1H-imidazole;hydrochlorideMFCD08668438MFCD202572304-[2-chloroethyl]imidazole hydrochloride

名称をさらに表示

5-(2-Chloroethyl)2-(2-Chloroethyl)-1H-imidazole1H-IMidazole,5-(2-chloroethyl)-, hydrochloride (1:1)

1H-Imidazole, 4-(2-chloroethyl)-, monohydrochlorideSCHEMBL7961043SCHEMBL11356357DTXSID30982840VLYMIZRIGGBHSH-UHFFFAOYSA-NNSC2347324-(2-Chloroethyl)-1H-imidazole HCl5-(2-Chloroethyl)-1H-imidazole HCl

データベース識別子

CAS: 6429-10-3
PubChem CID: 21715369

物性

構造計算による物性

極性表面積: 28.7 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: 9
形式電荷: 0
複雑度: 67

物理化学的性質

貯蔵温度: Inert atmosphere,Room Temperature

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.