3-クロロ-5-(トリフルオロメチル)ピリド-2-イルヒドラジン

3-Chloro-2-hydrazinyl-5-(trifluoromethyl)pyridine

HCID 1272691

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 89570-82-1
標準SMILES: NNc1ncc(C(F)(F)F)cc1Cl
InChIKey: KHFKSHYCVQZAQP-UHFFFAOYSA-N
分子式: C6H5ClF3N3
平均分子量: 211.57 g/mol
単同位体質量: 211.0124095

名称と識別子

優先名称: 3-Chloro-2-hydrazinyl-5-(trifluoromethyl)pyridine
IUPAC: [3-chloro-5-(trifluoromethyl)-2-pyridinyl]hydrazine
現地名: 3-クロロ-5-(トリフルオロメチル)ピリド-2-イルヒドラジン
英語名: 3-Chloro-5-(trifluoromethyl)pyrid-2-ylhydrazine
分子式: C6H5ClF3N3
分子量: 211.57

名称と別名

89570-82-13-chloro-2-hydrazinyl-5-(trifluoromethyl)pyridineDTXSID80361540RefChem:499767DTXCID50312589670-843-23-chloro-5-(trifluoromethyl)pyrid-2-ylhydrazine3-chloro-2-hydrazino-5-(trifluoromethyl)pyridineMFCD000678651-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)hydrazine[3-chloro-5-(trifluoromethyl)pyridin-2-yl]hydrazine3-Chloro-5-(trifluoromethyl)pyrid-2-yl hydrazine

名称をさらに表示

3-クロロ-5-(トリフルオロメチル)ピリド-2-イルヒドラジンBUTTPARK 24\07-70AKOS BBS-000064903-CHLORO-5-(TRIFLUOROMETHYL)PYRID-2-YLHY3-CHLORO-5-(TRIFLUOROMETHYL)PYRIDIN-2-HYDRAZINE3-chloro-2-diazanyl-5-(trifluoromethyl)pyridine

[3-Chloro-5-(trifluoromethyl)-2-pyridyl]hydrazine3-chloro-2-hydrazineyl-5-(trifluoromethyl)pyridine3-chloro-5-(trifluoromethyl)-2-pyridylhydrazine3-Chloro-5-(trifluoromethyl)pyridin-2-ylhydrazineSCHEMBL18337982(1H)-Pyridinone, 3-chloro-5-(trifluoromethyl)-, hydrazoneSBB042507STK731601

データベース識別子

CAS: 89570-82-1
PubChem CID: 1272691
DTXSID: DTXSID80361540
EC Number: 670-843-2

物性

構造計算による物性

XLogP: 1.9
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: 6
回転可能結合数: 1
重原子数: 13
形式電荷: 0
複雑度: 175

物理化学的性質

融点: 90 °C · 90 °C
沸点: 201.2 · 201.2±50.0 °C(Predicted)
比重(密度): 1.62 · 1.62±0.1 g/cm3(Predicted)
貯蔵温度: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
外見: solid
酸解離定数(Pka): 7.83 · 7.83±0.70(Predicted)
色: Pale brown
CAS データベース: 89570 · 89570-82-1(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301 (66.7%): 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, 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.