CAS 1040681-74-0 2-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylic acid (HCID 28307766)

部分構造検索類似構造を探す

基本情報

CAS: 1040681-74-0
標準SMILES: O=C(O)c1c(C(F)(F)F)ccnc1F
InChIKey: ABXMDMDQUVWALB-UHFFFAOYSA-N
分子式: C7H3F4NO2
平均分子量: 209.1 g/mol
単同位体質量: 209.00999122

概要

2-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylic acid is a member of pyridines and an aromatic carboxylic acid.

名称と識別子

優先名称: 2-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylic acid
IUPAC: 2-fluoro-4-(trifluoromethyl)pyridine-3-carboxylic acid
現地名: 2-フルオロ-4-(トリフルオロメチル)ピリジン-3-カルボン酸
英語名: 2-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylicacid
分子式: C7H3F4NO2
分子量: 209.1

名称と別名

1040681-74-02-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylic acidDTXSID80651276RefChem:260919DTXCID80602026631-275-02-Fluoro-4-(trifluoromethyl)nicotinic acid2-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylicacidMFCD106874032-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylic acid, 97%MS-20088CS-0155603

名称をさらに表示

2-フルオロ-4-(トリフルオロメチル)ピリジン-3-カルボン酸2-Fluoro-4-(tri?uoromethyl)nicotinic acid2-Fluoro-4-(trifluoroMethyl)pyridin-3-carboxylic acid2-Fluoro-4-(trifluoromethyl)-3-pyridinecarboxylic acid3-Pyridinecarboxylic acid, 2-fluoro-4-(trifluoromethyl)-2-Fluoro-4-(trifluoromethyl)pyridine-3-carboxylic acid 97%

D82229AMY177322-Fluoro-4-trifluoromorb3030925SCHEMBL1699267CHEBI:194798Fr13157SBB094146

データベース識別子

物性

構造計算による物性

XLogP: 1.7
極性表面積: 50.2 Å²
水素結合供与体数: 1
水素結合受容体数: 7
回転可能結合数: 1
重原子数: 14
形式電荷: 0
複雑度: 230

物理化学的性質

融点: 95 · 95-100 °C
貯蔵温度: Inert atmosphere,Room Temperature
外見: solid
InChI: 1S/C7H3F4NO2/c8-5-4(6(13)14)3(1-2-12-5)7(9,10)11/h1-2H,(H,13,14)
InChIKey: ABXMDMDQUVWALB-UHFFFAOYSA-N
SMILES: OC(=O)c1c(F)nccc1C(F)(F)F

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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

安全データ

wgk: 2
hs_code: 2933399990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
hazard_class: IRRITANT
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids

化学と産業

サプライヤー27 社

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]

安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]

化合物ノート

読み込み中…