CAS 34547-28-9 2-(4-Fluorophenyl)acetohydrazide (HCID 3771612)

基本情報

CAS: 34547-28-9
標準SMILES: NNC(=O)Cc1ccc(F)cc1
InChIKey: PFBNINAURUGQRR-UHFFFAOYSA-N
分子式: C8H9FN2O
平均分子量: 168.17 g/mol
単同位体質量: 168.06989113

名称と識別子

優先名称: 2-(4-Fluorophenyl)acetohydrazide
IUPAC: 2-(4-fluorophenyl)acetohydrazide
英語名: 4-Fluorophenyl acetic hydrazide
分子式: C8H9FN2O
分子量: 168.17

名称と別名

2-(4-fluorophenyl)acetohydrazide34547-28-9DTXSID30396201RefChem:457719DTXCID20347060817-999-14-FLUOROPHENYLACETIC HYDRAZIDE(4-Fluorophenyl)acetic acid hydrazide(4-Fluoro-phenyl)-acetic acid hydrazideP-FLUOROPHENYLACETYL HYDRAZINEMFCD066550534-FLUOROPHENYL ACETIC HYDRAZIDE

名称をさらに表示

4-flourophenyl acetic hydrazideOf acetyl hydrazine fluorophenyl2-(4-fluorophenyl)ethylacylhydrazine4-Fluorobenzeneacetic acid hydrazide

Benzeneacetic acid, 4-fluoro-, hydrazide4-Fluorophenylacetic acid hydrazide4-Fluorophenylacetyl hydrazine45Y4-FLUOROPHENYL ACETICSCHEMBL754150PFBNINAURUGQRR-UHFFFAOYSA-N2-(4-fluorophenyl)acetic hydrazide

データベース識別子

CAS: 34547-28-9
PubChem CID: 3771612
DTXSID: DTXSID30396201
EC Number: 817-999-1

物性

構造計算による物性

XLogP: 0.6
極性表面積: 55.1 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: 2
重原子数: 12
形式電荷: 0
複雑度: 155

物理化学的性質

沸点: 370.6 · 370.6±25.0 °C(Predicted)
比重(密度): 1.235 · 1.235±0.06 g/cm3(Predicted)
貯蔵温度: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
酸解離定数(Pka): 13.06 · 13.06±0.18(Predicted)

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, 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)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.