2-フルオロ-5-(トリフルオロメチル)ベンズアルデヒド

2-Fluoro-5-(trifluoromethyl)benzaldehyde

HCID 2734904

ノート反応

部分構造検索類似構造を探す

基本情報

CAS: 146137-78-2
標準SMILES: O=Cc1cc(C(F)(F)F)ccc1F
InChIKey: IDLNLGMUINCSGS-UHFFFAOYSA-N
分子式: C8H4F4O
平均分子量: 192.11 g/mol
単同位体質量: 192.01982763

名称と識別子

優先名称: 2-Fluoro-5-(trifluoromethyl)benzaldehyde
IUPAC: 2-fluoro-5-(trifluoromethyl)benzaldehyde
現地名: 2-フルオロ-5-(トリフルオロメチル)ベンズアルデヒド
英語名: 2-Fluoro-5-(trifluoromethyl)benzaldehyde
分子式: C8H4F4O
分子量: 192.11

名称と別名

2-Fluoro-5-(trifluoromethyl)benzaldehyde146137-78-2DTXSID30370566RefChem:260969DTXCID00321601626-370-92-fluoro-5-trifluoromethylbenzaldehydeBenzaldehyde, 2-fluoro-5-(trifluoromethyl)-MFCD000613112-Fluoro-5-trifluoromethyl-benzaldehydeAC-2814DS-11306

名称をさらに表示

2-フルオロ-5-(トリフルオロメチル)ベンズアルデヒド4-Fluoro-3-formylbenzotrifluorideà,à,à,6-tetrafluoro-m-tolualdehydeα,α,α,6-Tetrafluoro-m-tolualdehyde2-Fluoro-5-(trifluoromethyl)benzaldehyde>Benzaldehyde, 2-fluoro-5-(trifluoromethyl)-2-Fluoro-5-(trifluoromethyl)benzaldehyde97%2-Fluoro-5-(trifluoromethyl)benzaldehyde 97%alpha,alpha,alpha,6-Tetrafluoro-m-tolualdehyde4-Fluoro-3-formylbenzotrifluoride, alpha,alpha,alpha,6-Tetrafluoro-m-tolualdehyde

SY0030302-fluoro-5-(trifluoromethyl) benzaldehydeEN300-764642-fluoro-5-(FT-0612345SCHEMBL269221SCHEMBL483405BBL028088

データベース識別子

CAS: 146137-78-2
PubChem CID: 2734904
DTXSID: DTXSID30370566
EC Number: 626-370-9
Nikkaji: J256.546C

物性

構造計算による物性

XLogP: 2.4
極性表面積: 17.1 Å²
水素結合供与体数: 0
水素結合受容体数: 5
回転可能結合数: 1
重原子数: 13
形式電荷: 0
複雑度: 189

物理化学的性質

沸点: 176 °C · 176 °C(lit.)
比重(密度): 1.36 g/mL · 1.36 g/mL at 25 °C(lit.)
屈折率: 20 · n20/D 1.452(lit.)
闪点: 170 °F · 170 °F
貯蔵温度: 2 · under inert gas (nitrogen or Argon) at 2-8°C
外見: clear liquid
色: Colorless to Light yellow to Light orange
BRN: 5810686 · 5810686
CAS データベース: 146137 · 146137-78-2(CAS DataBase Reference)

化学的性質

化学的特性clear light yellow liquid

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 49 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.