5-フルオロ-2-(トリフルオロメチル)ベンズアルデヒド

5-Fluoro-2-(trifluoromethyl)benzaldehyde

HCID 2737538

基本情報

CAS
90381-08-1
標準SMILES
O=Cc1cc(F)ccc1C(F)(F)F
InChIKey
MITVIZWTPVYRDO-UHFFFAOYSA-N
分子式
C8H4F4O
平均分子量
192.11 g/mol
単同位体質量
192.0198274

名称と識別子

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

名称と別名

5-fluoro-2-(trifluoromethyl)benzaldehyde90381-08-1DTXSID50372123RefChem:102618DTXCID10323156642-472-65-fluoro-2-trifluoromethylbenzaldehyde2-Trifluoromethyl-5-fluorobenzaldehydeMFCD002362765-fluoro-2-trifluoromethyl-benzaldehyde5-Fluoro-2-trifluoromethylbenzaldehyde;2-Trifluoromethyl-5-fluorobenzaldehydeBenzaldehyde, 5-fluoro-2-(trifluoromethyl)-
名称をさらに表示
5-フルオロ-2-(トリフルオロメチル)ベンズアルデヒドOTF-BAD-5Fà,à,à,5-tetrafluoro-o-tolualdehyde5-Fluoro-2-(trifluoromethyl)benzaldehyde97%5-Fluoro-2-(trifluoromethyl)benzaldehyde 97%alpha,alpha,alpha,5-Tetrafluoro-o-tolualdehyde5-Fluoro-2-(trifluoroMethyl)benzaldehyde, 98%+5-fluoro-2-(trifluoromethyl)benzaldehyde - [F87834]
SCHEMBL1073123CHEMBL4464903SCHEMBL16401745SCHEMBL30266598CL8375SBB091372AKOS0052583195-fluoro-2-(trifluoromethy)-benzaldehyde

データベース識別子

CAS
90381-08-1
PubChem CID
2737538
DTXSID
DTXSID50372123
ChEMBL
CHEMBL4464903
EC Number
642-472-6

物性

構造計算による物性

XLogP
2.4
極性表面積
17.1 Ų
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

物理化学的性質

沸点
189 ℃ · 189℃
比重(密度)
1.383 · 1.383
屈折率
1.4495 · 1.4495
闪点
70 ℃ · 70℃
貯蔵温度
Inert atmosphere,Room Temperature
CAS データベース
90381 · 90381-08-1(CAS DataBase Reference)

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (11.1%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (88.9%): Causes skin irritation [Warning Skin corrosion/irritation];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (88.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H411 (11.1%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 9 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (11.1%);Skin Irrit. 2 (88.9%);Eye Irrit. 2 (100%);STOT SE 3 (88.9%);Aquatic Chronic 2 (11.1%)

安全データ

wgk
3
hs_code
2913000090
risk_code
36/37/38-51-36-22
hazard_code
Xi,Xn
safety_code
26-36
hazard_class
IRRITANT

化学と産業

サプライヤー83 社

常州帝通化工有限公司+86-0519-88298848 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

関連反応

4 件

化合物ノート

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