4-Chloroquinazoline 4-氯喹唑啉

CAS 5190-68-1 MFCD00228682

化学结构图

5190-68-1
SMILES: Clc1ncnc2ccccc12

化学属性

Mol. FormulaC8H5ClN2
Mol. Weight164.59
Melting Point96-100°C
Appearance 本品粗品为黄色固体，纯品为白色针状晶体，m.p.97～98℃，不溶于水，溶于氯仿、四氯化碳等溶剂。
Stability对湿度敏感
Boiling Point281.0±13.0 °C at 760 mmHg

别名和识别编码

Chemical Name4-Chloroquinazoline
CAS Number5190-68-1
Alfabeta NameCHLOROQUINAZOLINE 4--
MDL NumberMFCD00228682
Synonym 4-Chloroquinazoline {LY} 4-Chloroquinazoline {} {LY} 4-Chloroquinazoline {} {} {LY} 4-Chloroquinazoline {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloroquinazoline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloroqu
Chemical Name Translation4-氯喹唑啉
InChIKeyGVRRXASZZAKBMN-UHFFFAOYSA-N
PubChem Substance ID78864
LabNetwork Molecule IDLN00122211
InChIInChI=1S/C8H5ClN2/c9-8-6-3-1-2-4-7(6)10-5-11-8/h1-5H
Canonical SMILESClC1=C2C=CC=CC2=NC=N1
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分类

  • {SNA} Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Quinazolines
  • Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Quinazolines
  • {Chemicalbook} 农药中间体: 杀螨剂中间体

安全信息

Warnings IRRITANT
GHS Symbol
WGK Germany3
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。
  • P301+P310
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • 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。
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
  • H315 Causes skin irritation 会刺激皮肤
  • H318 Causes serious eye damage 严重伤害眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
Hazard Codes Xi T
Safety Statements
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
  • 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；
  • 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
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R25 Toxic if swallowed 吞咽有毒
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
UN Number 2811
Storage condition -20°C, sealed storage, away from moisture {LY} -20°C, sealed storage, away from moisture {} {LY} -20°C, sealed storage, away from moisture {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, awa

其他信息

  • 上游原料:氢氧化铵 --> 五氯化磷 --> 邻氨基苯甲酸 --> 喹唑啉 --> 四口烧瓶 --> 4-羟基喹唑啉
  • Sigma Aldrich:5190-68-1(sigmaaldrich)
  • 下游产品:
  • MOL 文件:5190-68-1.mol
  • 方法一:其制备方法是在四口烧瓶中加入4-(3H)喹唑啉、五氯化磷和三氯氧磷，加热回流2h，反应毕，减压蒸去POCl 3 ，固体残渣用氯仿溶解，倾入冰水混合物中，同时搅拌下滴加36％氨水，使混合液的pH值保持在6～8，分出有机层，干燥，脱溶剂得产品。
  • 用途一:4-氯喹唑啉是杀螨剂喹螨醚的中间体。
  • 方法二:将邻氨基苯甲酸与甲酰胺加热环合，生成喹唑酮-4，然后以五氯化磷和三氯氧磷氯化得到该品。
  • 用途二:常咯啉的中间体。

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Halogenated Heterocycles 卤代杂环
  5. Quinazolines - Halogenated Heterocycles

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