4-Fluorophenylacetonitrile 对氟苯乙腈

CAS 459-22-3 MFCD00001917

化学结构图

459-22-3
SMILES: N#CCc1ccc(F)cc1

化学属性

Mol. FormulaC8H6FN
Mol. Weight135.14
Boiling Point234.2°C at 760 mmHg
TSCAT
Refractive index1.4990 to 1.5020
Density1.126
Flash Point108°C
pH:A
Melting Point86 °C

别名和识别编码

Chemical Name4-Fluorophenylacetonitrile
CAS Number459-22-3
Alfabeta NameFLUOROPHENYLACETONITRILE 4-
MDL NumberMFCD00001917
Synonym 4-Fluorophenylacetonitrile {LY} 4-Fluorophenylacetonitrile {} {LY} 4-Fluorophenylacetonitrile {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorophenylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY}
PubChem Substance ID68016
EC Number207-286-8
Beilstein Registry Number1907764
Reaxys-RN1907764
Chemical Name Translation对氟苯乙腈
InChIKeyJHQBLYITVCBGTO-UHFFFAOYSA-N
Wiswesser Line NotationNC1R DF
LabNetwork Molecule IDLN00009479
InChIInChI=1S/C8H6FN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5H2
Canonical SMILESN#CCC1=CC=C(F)C=C1
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分类

  • Aryl Fluorinated Building Blocks, Building Blocks, C8 to C9, C8-C12, Chemical Synthesis, Cyanides/Nitriles, Fluorinated Building Blocks, Nitrogen Compounds, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment
  • {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C8 to C9, C8-C12, Chemical Synthesis, Cyanides/Nitriles, Fluorinated Building Blocks, Nitrogen Compounds, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks

相关文献及参考

  • Aldrich MSDS 1 , 969:B / Corp MSDS 1 (1), 1720:D / FT-IR 2 (2), 3123:A / FT-IR 1 (2), 433:D / FT-NMR 1 (2), 1493:A / IR-Spectra (2), 976:F / IR-Spectra (3), 1121:H / NMR-Reference 2 (2), 408:D / RegBook 1 (2), 2113:I / Sax 6 , 1445 / Sigma FT-IR 1 (2), 580:B / Structure Index 1 , 334:D:1 / Vapor Phase 3 , 1403:D
  • Short: IV/17 Title: Static Dielectric Constants of Pure Liquids and Binary Liquid Mixtures Author: Wohlfarth, Ch. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: IV/17 Year: 2008 Keyword: binary liquid mixtures; inorganic liquid; organic liquid; organoboron liquid; organometallic liquid; organophosphorus liquid; organosilicon liquid; pure liquids; static dielectric constant ISBN: 978-3-540-75505-0 (Print) ISBN: 978-3-540-75506-7 (Online) Internet Resource: DOI:10.1007/978-3-540-75506-7 RefComment: VII, 203 p., Hardcover RefComment: Written for scientists and engineers in the fields of physics, chemistry and physical chemistry Abstract: This Landolt-Börnstein volume IV/17 is a supplement to the volume IV/6 "Static Dielectric Constants of Pure Liquids and Binary Liquid Mixtures" and provides dielectric constant data published in the years 1991-2006. Included in this volume are static dielectric constants of pure liquids and binary liquid mixtures at different temperatures and saturation vapor pressures including liquid elements, inorganic liquids, organic liquids and their mixtures. Not all published data could be included in the printed version, but the electronic version contains all available data and references.
  • 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, TOXIC
GHS Symbol
WGK Germany3
Hazard Codes 6.1 Xn Xn,T,Xi
Hazard statements
  • H301+H311+H331
  • H315 Causes skin irritation 会刺激皮肤
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H302+H312+H332
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSAM0210000
Precautionary statements
  • 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。
  • 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。
  • P302+P350
  • P304+P340+P311
  • P305+P351+P338
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P332+P313
  • P337+P313
  • P403+P233
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Safety Statements
  • 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；
  • S26/36/37/39
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
Risk Statements
  • R20/20/22
  • 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
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
UN Number 3276 UN 3276 6.1/PG 3 UN3276
Packing GroupIII
Hazard Class6.1 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 42 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#07881

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

  • 用途一:用于有机合成
  • Alfa Aesar:4-氟苯乙腈,97% 4-Fluorophenylacetonitrile, 98+%(459-22-3)
  • TSCA:T
  • 对氟苯乙腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 F0258 4-氟苄基氰 4-Fluorobenzyl Cyanide 25G 566元 2014/06/02 F0258 4-氟苄基氰 4-Fluorobenzyl Cyanide 250G 3480元 2010/06/21 146720250 对氟苯乙腈 4-Fluorophenylacetonitrile 99% 25 GR 518元
  • Hazard Note:Toxic
  • 下游产品:4-氰-4-(4-氟苯基)环己酮,98%
  • MOL 文件:459-22-3.mol
  • Sigma Aldrich:459-22-3(sigmaaldrich)
  • Acros Organics:4-氟苯乙腈 4-Fluorophenylacetonitrile, 99%(459-22-3)
  • TCI Shanghai:4-氟苄基氰 4-Fluorobenzyl Cyanide,>;98.0%(GC)(459-22-3)
  • 图谱信息:对氟苯乙腈(459-22-3)红外图谱(IR1) 对氟苯乙腈(459-22-3)核磁图( 13 CNMR) 对氟苯乙腈(459-22-3)核磁图( 1 HNMR) 对氟苯乙腈(459-22-3)质谱(MS)
  • MSDS 信息:4-Fluorophenylacetonitrile(459-22-3).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. Other Fluorinated Organic Building Blocks - Organic Fluorinated Building Blocks
  6. Aryl Fluorinated Building Blocks 芳基氟化物
  7. C8-C12 - 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. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles - Nitrogen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles - Nitrogen Compounds
  6. C8 to C9 - Cyanides/Nitriles
  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. Nitrogen Compounds 氮化合物
  5. Cyanides/Nitriles
  6. C6 to C7

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