2-クロロ-6-ヒドラジノピリジン

2-Chloro-6-hydrazinopyridine

HCID 320004CAS 5193-03-3

部分構造検索類似構造を探す

基本情報

標準SMILES: NNc1cccc(Cl)n1
InChIKey: HFTSPKIAXHZROA-UHFFFAOYSA-N
分子式: C5H6ClN3
平均分子量: 143.57 g/mol
単同位体質量: 143.02502487

名称と識別子

優先名称: 2-Chloro-6-hydrazinopyridine
IUPAC: (6-chloro-2-pyridinyl)hydrazine
現地名: 2-クロロ-6-ヒドラジノピリジン
英語名: 2-Chloro-6-hydrazinopyridine
分子式: C5H6ClN3
分子量: 143.57

名称と別名

2-Chloro-6-hydrazinopyridineDTXSID50313076RefChem:469648DTXCID40264200678-881-15193-03-32-chloro-6-hydrazinylpyridine(6-chloro-2-pyridyl)hydrazineMFCD00214724(6-chloropyridin-2-yl)hydrazineNSC2661566-chloro-2-pyridylhydrazine

名称をさらに表示

2-クロロ-6-ヒドラジノピリジン(6-クロロ-2-ピリジル)ヒドラジン2-CHLOROPYRIDINEHYDRAZINE2-Chloro-6hydrazine pyridine6-CHLOROPYRIDIN-2-YLHYDRAZINE6-Chloropyridine-2-ylhydrazinePyridine, 2-chloro-6-hydrazinyl-2-Chloro-6-hydrazinopyridine >(6-Chloro-2-pyridyl)hydrazine, 95%

pyridine, 2-chloro-6-hydrazino-2(1H)-Pyridinone, 6-chloro-, hydrazone(6-chloro-pyridin-2-yl)-hydrazineBionet2_0002122-hydrazino-6-chloropyridine6-chloro-2-hydrazinopyridine6-chloro-2-hydrazonopyridineSCHEMBL187609

データベース識別子

CAS: 5193-03-3
PubChem CID: 320004
DTXSID: DTXSID50313076
EC Number: 678-881-1
Nikkaji: J2.441.813H

物性

構造計算による物性

XLogP: 1.4
極性表面積: 50.9 Å²
水素結合供与体数: 2
水素結合受容体数: 3
回転可能結合数: 1
重原子数: 9
形式電荷: 0
複雑度: 88.3

物理化学的性質

融点: 118 °C · 118°C
沸点: 118 °C · 118°C
比重(密度): 1.43 · 1.43±0.1 g/cm3(Predicted)
闪点: 117 · 117-120°C
貯蔵温度: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
外見: powder to crystal
酸解離定数(Pka): 9.08 · 9.08±0.70(Predicted)
色: Light yellow to Brown
InChI: InChI=1S/C5H6ClN3/c6-4-2-1-3-5(8-4)9-7/h1-3H,7H2,(H,8,9)
InChIKey: HFTSPKIAXHZROA-UHFFFAOYSA-N
SMILES: C1(Cl)=NC(NN)=CC=C1
CAS データベース: 5193 · 5193-03-3(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301 (22.2%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 9 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.