4-Fluorobenzotrifluoride 4-氟三氟甲苯

CAS 402-44-8 MFCD00000399

化学结构图

402-44-8
SMILES: Fc1ccc(C(F)(F)F)cc1

化学属性

Mol. FormulaC7H4F4
Mol. Weight164.10
Boiling Point104.5°C at 760 mmHg
Melting Point-42--41.7°C
TSCAT
Refractive index1.4000 to 1.4020
Density1.293
Flash Point11°C
Appearance 无色液体

别名和识别编码

Chemical Name4-Fluorobenzotrifluoride
CAS Number402-44-8
Alfabeta NameFLUOROBENZOTRIFLUORIDE 4-
MDL NumberMFCD00000399
Synonym 1-Fluoro-4-(trifluoromethyl)benzene {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(trifluoromethyl)benzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Fluoro-4-(tr
PubChem Substance ID67873
EC Number206-944-1
Beilstein Registry Number5(3)680
Chemical Name Translation4-氟三氟甲苯
Reaxys-RN1909390
InChIKeyUNNNAIWPDLRVRN-UHFFFAOYSA-N
LabNetwork Molecule IDLN00115936
InChIInChI=1S/C7H4F4/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H
Canonical SMILESFC(C1=CC=C(F)C=C1)(F)F
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分类

  • {SNA} Aryl, Aryl Fluorinated Building Blocks, Building Blocks, C7, Chemical Synthesis, Fluorinated Building Blocks, Halogenated Hydrocarbons, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment

相关文献及参考

  • Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR) Data is therefore of major interest to all scientists and engineers who intend to use NMR to study the structure and the binding of molecules. Volume III/35 "NMR-Data" is divided into several subvolumes and parts. Subvolume III/35A contains the nuclei 11B and 31P, subvolume III/35B contains the nuclei 19F and 15N, subvolume III/35C contains the nucleus 1H, subvolume III/35D contains the nucleus 13C, subvolume III/35E contains the nucleus 17O, and subvolume III/35G contains the nucleus 77Se. More nuclei will be presented later.
  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids

安全信息

Warnings IRRITANT, FLAMMABLE
GHS Symbol
WGK Germany3
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
  • H319 Causes serious eye irritation 严重刺激眼睛
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
  • P241+P242+P243
  • 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。
  • 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。
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332 IF SKIN irritation occurs: 如果发生皮肤刺激：
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P403 Store in a well-ventilated place. 储存在通风良好的地方。
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Packing GroupII
UN Number 1993 UN 1993 3/PG 2
Risk Statements
  • R11 Highly flammable 非常易燃
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • 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；
  • S33 Take precautionary measures against static discharges 对静电采取预防措施；
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
Hazard Codes 3
Storage condition -20°C {LY} -20°C 0-10 0-10°C Refrigerator {} {LY} -20°C {} {} {LY} -20°C {} {} {} {LY} -20°C {} {} {} {} {LY} -20°C {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Hazard Class3
RTECS

其他信息

  • TSCA:T
  • Sigma Aldrich:402-44-8(sigmaaldrich)
  • 4-氟三氟甲苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 F0357 4-氟三氟甲苯 4-Fluorobenzotrifluoride 5G 542元 2014/06/02 F0357 4-氟三氟甲苯 4-Fluorobenzotrifluoride 25G 1910元 2010/06/21 187390250 4-氟三氟甲苯 4-Fluorobenzotrifluoride 97% 25 GR 2156元
  • TCI Shanghai:4-氟三氟甲苯 4-Fluorobenzotrifluoride,>;98.0%(GC)(402-44-8)
  • Acros Organics:4-氟三氟甲苯 4-Fluorobenzotrifluoride, 97%(402-44-8)
  • 上游原料:亚硝酸钠 --> 对甲苯胺
  • 用途一:用作染料、农药、医药中间体
  • Alfa Aesar:4-氟三氟甲苯,98+% 4-Fluorobenzotrifluoride, 98+%(402-44-8)
  • Hazard Note:Flammable/Irritant
  • 图谱信息:4-氟三氟甲苯(402-44-8)红外图谱(IR1) 4-氟三氟甲苯(402-44-8)核磁图( 1 HNMR) 4-氟三氟甲苯(402-44-8)质谱(MS) 4-氟三氟甲苯(402-44-8)核磁图( 13 CNMR)
  • 4-氟三氟甲苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 F0357 4-氟三氟甲苯 4-Fluorobenzotrifluoride 5G 520元 2011/04/16 F0357 4-氟三氟甲苯 4-Fluorobenzotrifluoride 25G 1820元 2010/06/21 187390250 4-氟三氟甲苯 4-Fluorobenzotrifluoride 97% 25 GR 2156元
  • MOL 文件:402-44-8.mol
  • 下游产品:2-氟-5-三氟甲基苯甲酸
  • MSDS 信息:alpha,alpha,alpha,4-tetrafluorotoluene(402-44-8).msds

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Fluorinated Building Blocks 氟化物砌块
  4. Organic Fluorinated Building Blocks - Fluorinated Building Blocks
  5. Trifluoromethyl 三氟甲基
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Fluorinated Building Blocks 氟化物砌块
  4. Organic Fluorinated Building Blocks - Fluorinated Building Blocks
  5. Other Fluorinated Organic Building Blocks - Organic Fluorinated Building Blocks
  6. Aryl Fluorinated Building Blocks 芳基氟化物
  7. C7 - Aryl Fluorinated Building Blocks
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Halogenated Hydrocarbons 卤代烃
  5. Aryl 芳基卤代烃
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Halogenated Hydrocarbons 卤代烃
  5. Aryl 芳基卤代烃
  6. C7 - Aryl
  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
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Halogenated Hydrocarbons 卤代烃
  5. Aryl 芳香卤代烃
  6. C6

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