2'-(Trifluoromethyl)acetanilide 2-(三氟甲基)乙酰苯胺

CAS 344-62-7 MFCD00013555

化学结构图

344-62-7
SMILES: CC(=O)Nc1ccccc1C(F)(F)F

化学属性

Mol. FormulaC9H8F3NO
Mol. Weight203.16
Melting Point94-97 °C
TSCANo

别名和识别编码

Chemical Name2'-(Trifluoromethyl)acetanilide
CAS Number344-62-7
Alfabeta NameTRIFLUOROMETHYLACETANILIDE 2()-'
MDL NumberMFCD00013555
Synonym 2'-(Trifluoromethyl)acetanilide {LY} 2'-(Trifluoromethyl)acetanilide {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-(Trifluoromethyl)acetanilide {} {} {} {} {} {} {} {} {} {}
EC Number206-453-2
Beilstein Registry Number2106815
Chemical Name Translation2-(三氟甲基)乙酰苯胺
InChIKeyOXDTZGRSCDEKGO-UHFFFAOYSA-N
Wiswesser Line NotationFXFFVMR B1
LabNetwork Molecule IDLN00239695
PubChem Substance ID67655
InChIInChI=1S/C9H8F3NO/c1-6(14)13-8-5-3-2-4-7(8)9(10,11)12/h2-5H,1H3,(H,13,14)
Canonical SMILESCC(NC1=CC=CC=C1C(F)(F)F)=O
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; amide; 1fragment

相关文献及参考

  • Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C1 Year: 2000 ISBN: 3-540-66780-6 ISBN: 978-3-540-66780-3 Internet Resource: DOI:10.1007/b60149 RefComment: VII, 310 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

Warnings IRRITANT
RTECSAN3760000
Safety Statements
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
Hazard Codes Xi 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1210 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   19,20,1971

Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled 吸入可能导致过敏或哮喘症状或呼吸困难
Precautionary statements
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P301+P317
  • P304+P340
  • P305+P351+P338
  • P330 Rinse mouth. 漱口
  • P337+P317
  • P342+P316
  • P403 Store in a well-ventilated place. 储存在通风良好的地方。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....

其他信息

  • MOL 文件:344-62-7.mol
  • Acros Organics:N1-[2-(trifluoromethyl)phenyl]acetamide(344-62-7)
  • Hazard Note:Irritant
  • 2-(三氟甲基)乙酰苯胺价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 A16590 2'-(三氟甲基)乙酰苯胺, 98% 2'-(Trifluoromethyl)acetanilide, 98% 5g 556元 2010/05/25 A16590 2'-(三氟甲基)乙酰苯胺, 98% 2'-(Trifluoromethyl)acetanilide, 98% 25g 2240元 2010/05/25 A16590 2'-(三氟甲基)乙酰苯胺, 98% 2'-(Trifluoromethyl)acetanilide, 98% 100g 7154元
  • Alfa Aesar:2'-(三氟甲基)乙酰苯胺,98% 2'-(Trifluoromethyl)acetanilide, 98%(344-62-7)
  • Sigma Aldrich:344-62-7(sigmaaldrich)

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物

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