5-(chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride

HCID 22285332

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基本情報

CAS: 104256-69-1
標準SMILES: Cl.Cn1ncnc1CCl
InChIKey: ZESCZOKYYXYNNQ-UHFFFAOYSA-N
分子式: C4H7Cl2N3
平均分子量: 168.02 g/mol
単同位体質量: 167.0017026

名称と識別子

優先名称: 5-(chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride
IUPAC: 5-(chloromethyl)-1-methyl-1,2,4-triazole;hydrochloride
英語名: 5-Chloromethyl-1-methyl-1H-[1,2,4]triazole hydrochloride
分子式: C4H7Cl2N3
分子量: 168.02

名称と別名

104256-69-15-(CHLOROMETHYL)-1-METHYL-1H-1,2,4-TRIAZOLE HYDROCHLORIDERefChem:530927850-438-95-Chloromethyl-1-methyl-1H-[1,2,4]triazole hydrochlorideMFCD098632585-(chloromethyl)-1-methyl-1,2,4-triazole;hydrochloride1H-1,2,4-Triazole,5-(chloromethyl)-1-methyl-, hydrochloride (1:1)ZESCZOKYYXYNNQ-UHFFFAOYSA-N5-(chloromethyl)-1-methyl-1,2,4-triazole hydrochloride5-Chloromethyl-1-methyl-1H-[1,2,4]triazole HClSCHEMBL941062

名称をさらに表示

5-(chloromethyl)-1-methyl-1,2,4-triazole

5-chloromethyl-1-methyl-1H-1,2,4-triazole hydrochlorideTQP0651EEA25669AKOS022193571MB07932DA-16004SY194407CS-0076498

データベース識別子

CAS: 104256-69-1
PubChem CID: 22285332
EC Number: 850-438-9

物性

構造計算による物性

極性表面積: 30.7 Å²
水素結合供与体数: 1
水素結合受容体数: 2
回転可能結合数: 1
重原子数: 9
形式電荷: 0
複雑度: 77

物理化学的性質

貯蔵温度: Store at room temperature, keep dry and cool

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P330, P332+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.