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