4-Fluorophenyl acetate 4-氟苯基醋酸酯

CAS 405-51-6 MFCD00041361

化学结构图

405-51-6
SMILES: CC(=O)Oc1ccc(F)cc1

化学属性

Mol. FormulaC8H7FO2
Mol. Weight154.14
Refractive index1.4780 to 1.4810
Density1.180
Boiling Point194.9 °C at 760 mmHg
Flash Point87°C(lit.)
TSCANo

别名和识别编码

Chemical Name4-Fluorophenyl acetate
Synonym 4-Fluorophenyl acetate {LY} 4-Fluorophenyl acetate {} {LY} 4-Fluorophenyl acetate {} {} {LY} 4-Fluorophenyl acetate {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00041361
CAS Number405-51-6
PubChem Substance ID136253
Beilstein Registry Number6(4)775
Chemical Name Translation4-氟苯基醋酸酯
Reaxys-RN1864956
InChIKeyZNOREXRHKZXVPC-UHFFFAOYSA-N
LabNetwork Molecule IDLN00158313
InChIInChI=1S/C8H7FO2/c1-6(10)11-8-4-2-7(9)3-5-8/h2-5H,1H3
Canonical SMILESCC(=O)OC1=CC=C(F)C=C1
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; 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.

安全信息

WGK Germany3
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Packing GroupIII
Hazard Codes Xn
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;
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
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
  • R36 Irritating to eyes 刺激眼睛
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
Signal word
Precautionary statements
  • 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。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
  • P403+P235
Hazard statements
  • H227 Combustible liquid 可燃液体
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • MSDS 信息:1-Acetoxy-4-fluorobenzene(405-51-6).msds
  • 4-氟苯基醋酸酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A1429 醋酸4-氟苯基酯 4-Fluorophenyl Acetate 5G 383元 2010/05/25 B21356 4-氟苯基醋酸酯, 98% 4-Fluorophenyl acetate, 97% 5g 375元 2010/05/25 B21356 4-氟苯基醋酸酯, 98% 4-Fluorophenyl acetate, 97% 25g 1442元
  • MOL 文件:405-51-6.mol
  • 图谱信息:4-氟苯基醋酸酯(405-51-6)质谱(MS) 4-氟苯基醋酸酯(405-51-6)红外图谱(IR1)
  • Alfa Aesar:4-氟苯基醋酸酯,98% 4-Fluorophenyl acetate, 98%(405-51-6)
  • Sigma Aldrich:405-51-6(sigmaaldrich)
  • Hazard Note:Harmful
  • TCI Shanghai:乙酸-4-氟苯基酯 Acetic Acid 4-Fluorophenyl Ester,>;98.0%(GC)(405-51-6)

系列性分类


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