2-Chloro-1-fluoro-4-nitrobenzene 3-氯-4-氟硝基苯

CAS 350-30-1 MFCD00007206

化学结构图

350-30-1
SMILES: O=[N+]([O-])c1ccc(F)c(Cl)c1

化学属性

Mol. FormulaC6H3ClFNO2
Mol. Weight175.54
Melting Point40-42°C
Density1.61
Flash Point113°C
TSCANo
Boiling Point232.5°C at 760 mmHg
Appearance 白色结晶。熔点为44-47℃，沸点为227-237℃，闪点＞110℃。
Stability对空气敏感

别名和识别编码

Chemical Name2-Chloro-1-fluoro-4-nitrobenzene
CAS Number350-30-1
Alfabeta NameCHLOROFLUORONITROBENZENE 34---
MDL NumberMFCD00007206
PubChem Substance ID67688
EC Number206-499-3
Reaxys-RN1944997
Synonym 3-Chloro-4-fluoronitrobenzene {LY} 3-Chloro-4-fluoronitrobenzene {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoronitrobenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloro-4-fluoro
Beilstein Registry Number1944997
Chemical Name Translation3-氯-4-氟硝基苯
InChIKeyDPHCXXYPSYMICK-UHFFFAOYSA-N
Wiswesser Line NotationWNR CG DF
LabNetwork Molecule IDLN00008005
InChIInChI=1S/C6H3ClFNO2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H
Canonical SMILESO=[N+](C1=CC=C(F)C(Cl)=C1)[O-]
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分类

  • Aryl Fluorinated Building Blocks, Building Blocks, C6, Chemical Synthesis, Fluorinated Building Blocks, Nitro Compounds, Nitrogen Compounds, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C6, Chemical Synthesis, Fluorinated Building Blocks, Nitro Compounds, Nitrogen Compounds, 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

  • Aldrich MSDS 1 , 403:C / Corp MSDS 1 (1), 784:A / FT-IR 2 (2), 2290:A / FT-IR 1 (2), 116:B / FT-NMR 1 (2), 725:A / IR-Spectra (3), 816:B / NMR-Reference 2 (1), 1159:A / RegBook 1 (1), 1573:L / Structure Index 1 , 245:E:3 / Vapor Phase 3 , 1202:D
  • Beil. 5 ,I,130
  • 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
  • Short: III/35B Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Fluorine-19 and Nitrogen-15 Author: Balasubramanian, M.; Gupta, R.R.; Jain, M.; Perumal, S. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35B Year: 1998 ISBN: 3-540-63275-1 ISBN: 978-3-540-63275-7 Internet Resource: DOI:10.1007/b55685 RefComment: VII, 242 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 CO-ROM's.

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
Hazard Codes Xn Xn,Xi
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H302 Harmful if swallowed 吞食有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
RTECSCZ0720000
Precautionary statements
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • 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。
  • P301+P312+P330
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P308+P313
  • P332+P313
  • P337+P313
  • 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
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
UN Number UN2811 3077 2811
Safety Statements
  • 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；
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后，立即用大量…（由生产厂家指定）冲洗；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • 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；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
Risk Statements
  • 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
  • R22 Harmful if swallowed 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
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Packing GroupIII
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 Class9 
TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 102 ug/plate
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 116,217,1983

其他信息

  • 3-氯-4-氟硝基苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C1041 3-氯-4-氟硝基苯 3-Chloro-4-fluoronitrobenzene 25G 464元 2014/06/02 C1041 3-氯-4-氟硝基苯 3-Chloro-4-fluoronitrobenzene 250G 3250元 2010/06/21 303350250 3-氯-4-氟硝基苯 3-Chloro-4-fluoronitrobenzene 98% 25 GR 1060元
  • 上游原料:氟化苯 --> 对氟硝基苯
  • 类别:有毒物质
  • 可燃性危险特性:可燃; 火场分解有毒氮氧化物; 氟化物和氯化物烟雾
  • TCI Shanghai:3-氯-4-氟硝基苯 3-Chloro-4-fluoronitrobenzene,>;95.0%(GC)(350-30-1)
  • Hazard Note:Irritant
  • 图谱信息:3-氯-4-氟硝基苯(350-30-1)红外图谱(IR1) 3-氯-4-氟硝基苯(350-30-1)Raman光谱 3-氯-4-氟硝基苯(350-30-1)质谱(MS) 3-氯-4-氟硝基苯(350-30-1)核磁图( 1 HNMR) 3-氯-4-氟硝基苯(350-30-1)核磁图( 13 CNMR) 3-氯-4-氟硝基苯(350-30-1)红外图谱(IR2)
  • 方法一:用氟苯以混酸硝化，生成对氟硝基苯，然后以氯气氯化制得该品。
  • MSDS 信息:3-Chloro-4-fluoronitrobenzene(350-30-1).msds
  • 灭火剂:水, 二氧化碳, 干粉, 砂土
  • 储运特性:库房低温, 通风, 干燥
  • Sigma Aldrich:350-30-1(sigmaaldrich)
  • Alfa Aesar:2-氯-1-氟-4-硝基苯,98% 2-Chloro-1-fluoro-4-nitrobenzene, 98%(350-30-1)
  • 下游产品:氟哌酸 --> 2,4-二氯氟苯
  • Acros Organics:3-氯-4-氟硝基苯 3-Chloro-4-fluoronitrobenzene, 98%(350-30-1)
  • 用途一:氟哌酸的中间体。也可用于制3-氯-4-氟苯胺，是合成喹诺酸等药物的基本原料。
  • MOL 文件:350-30-1.mol

系列性分类

  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. Nitro Compounds 硝基化合物
  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. Isocyanides

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