4-Fluorobenzaldehyde 对氟苯甲醛

CAS 459-57-4 MFCD00003378

化学结构图

459-57-4
SMILES: O=Cc1ccc(F)cc1

化学属性

Mol. FormulaC7H5FO
Mol. Weight124.11
Boiling Point182°C at 760 mmHg
Melting Point-10°C
TSCAT
Density1.157
Refractive index1.5190 to 1.5220
Flash Point56°C(lit.)
Solubility不溶
Appearance 1.5200，相对密度 1.1570，不溶于水，溶于苯、甲苯等有机溶剂。 20 D 对氟苯甲醛为无色液体，m.p.-10℃，b.p.181℃，n
Stability对空气敏感

别名和识别编码

Chemical Name4-Fluorobenzaldehyde
CAS Number459-57-4
Alfabeta NameFLUOROBENZALDEHYDE 4-
MDL NumberMFCD00003378
Synonym 4-Fluorobenzaldehyde {LY} 4-Fluorobenzaldehyde {} {LY} 4-Fluorobenzaldehyde {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Fluorobenzaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
EC Number207-293-6
Beilstein Registry Number385857
PubChem Substance ID68023
Reaxys-RN385857
Chemical Name Translation对氟苯甲醛
LabNetwork Molecule IDLN00117266
InChIInChI=1S/C7H5FO/c8-7-3-1-6(5-9)2-4-7/h1-5H
Canonical SMILESO=CC1=CC=C(F)C=C1
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分类

  • {Chemicalbook} 农药中间体: 杀虫剂中间体: 拟除虫菊酯类杀虫剂
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; aldehyde; 1fragment
  • Inhibitors
  • {SNA} Aldehydes, Aryl Fluorinated Building Blocks, Building Blocks, C7, Carbonyl Compounds, Chemical Synthesis, Fluorinated Building Blocks, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • Pharmaceuticals
  • Intermediates & Fine Chemicals
  • Aromatics

产品应用

  • 用作农药．医药中间体．

相关文献及参考

  • For a facile route to 4-aryloxy phenols (Cu catalyzed substitution then Baeyer-Villiger reaction) see: Synthesis, 63 (1991). Ketones behave similarly.
  • Beilstein:7(1)132
  • Short: II/19b
  • Huang, X.H. et al.: J, Enz. Inhib. Med. Chem., 21, 413 (2006);
  • Short: II/2

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany2
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；
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
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
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。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • 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
  • P303+P361+P353
  • P305+P351+P338
  • P305+P351+P338+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.....
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen Air Sensitive {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {
Hazard Codes 3
UN Number 1989
Packing GroupIII
Hazard Class3

其他信息

  • 方法一:其制备方法是以对氯甲苯为原料，首先用氟化钾氟化，使其生成对氟甲苯，然后通过甲基氯化使其生成4-氟亚苄二氯，然后再水解得到对氟苯甲醛。 或者通过对氯苯甲醛用氟化钾氟化，直接得到对氟苯甲醛。
  • 用途二:对氟苯甲醛是制备3-苯氧基-4-氟苯甲醛的中间体，可以制备氟氯氰菊酯、氟氯苯菊酯等拟除虫菊酯。
  • Acros Organics:4-氟苯甲醛 4-Fluorobenzaldehyde, 98+%(459-57-4)
  • Hazard Note:Flammable
  • 用途三:用作农药．医药中间体．
  • 下游产品:(5-氟-2-甲基-1H-茚-3-基)乙酸 --> 4-吡唑-1-基苯甲醛 --> 2-[2-(4-氟苯基)-2-氧代-1-苯基乙基]-4-甲基-3-氧代-N-苯基戊酰胺 --> 对氟苯甲酸 --> 罗格列酮 --> 4-(咪唑-1-基)苯甲醛 --> 4-丙氧基苯甲醛 --> 3-苯氧基-4-氟苯甲醛 --> 对氟肉桂酸 --> 3-溴-4-氟苯甲醛 --> DL-对氟苯丙氨酸
  • TSCA:T
  • F:9-23
  • 上游原料:4-氯苯甲醛 --> 对氯甲苯 --> 对氟甲苯 --> 苄·二氯
  • 海关编码:29130000
  • 对氟苯甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 K4657001 4-氟苯甲醛;对氟苯甲醛 50ml 882元 2011/08/23 30090080 4-氟苯甲醛;对氟苯甲醛 50ml 783.9元 2011/04/16 F0191 4-氟苯甲醛 4-Fluorobenzaldehyde 25ML 391元
  • MSDS 信息:4-Fluorobenzaldehyde(459-57-4).msds
  • 图谱信息:对氟苯甲醛(459-57-4)质谱(MS) 对氟苯甲醛(459-57-4)核磁图( 1 HNMR) 对氟苯甲醛(459-57-4)红外图谱(IR1) 对氟苯甲醛(459-57-4)核磁图( 13 CNMR)
  • 敏感性:Air Sensitive
  • MOL 文件:459-57-4.mol
  • 检测方法:GC,NMR
  • TCI Shanghai:4-氟苯甲醛 4-Fluorobenzaldehyde,>;97.0%(GC)(459-57-4)
  • Sigma Aldrich:459-57-4(sigmaaldrich)
  • Alfa Aesar:4-氟苯甲醛,98% 4-Fluorobenzaldehyde, 98%(459-57-4)
  • 不溶于水，溶于乙醚、丙酮、苯和乙醇。
  • 用途一:用作农药、医药中间体

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. 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. Carbonyl Compounds 羰基化合物
  5. Aldehydes - Carbonyl Compounds
  6. C7 - Aldehydes
  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. Carbonyl Compounds 羰基化合物
  5. Aromatic aldehyde<including acetal,hemiacetal>
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aldehydes
  6. C10 to C21