4-Chloro-2-methylquinoline 2-甲基-4-氯喹啉

CAS 4295-06-1 MFCD00006757

化学结构图

4295-06-1
SMILES: Cc1cc(Cl)c2ccccc2n1

化学属性

Mol. FormulaC10H8ClN
Mol. Weight177.63
Refractive index1.6200 to 1.6240
Boiling Point269.499 °C at 760 mmHg
Density0.881 g/mL at 25 °C(lit.)
Flash Point>110°(230°F)
TSCANo
Melting Point39°C

别名和识别编码

Chemical Name4-Chloro-2-methylquinoline
CAS Number4295-06-1
PubChem Substance ID77973
EC Number224-300-8
MDL NumberMFCD00006757
Synonym 4-Chloro-2-methylquinoline {LY} 4-Chloro-2-methylquinoline {} {LY} 4-Chloro-2-methylquinoline {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-2-methylquinoline {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Chloro-2-met
Beilstein Registry Number3522
Alfabeta NameCHLOROMETHYLQUINOLINE 42---
Chemical Name Translation2-甲基-4-氯喹啉
Reaxys-RN3522
InChIKeyHQAIROMRVBVWSK-UHFFFAOYSA-N
LabNetwork Molecule IDLN00182638
InChIInChI=1S/C10H8ClN/c1-7-6-9(11)8-4-2-3-5-10(8)12-7/h2-6H,1H3
Canonical SMILESCC1=NC2=CC=CC=C2C(Cl)=C1
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分类

  • Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Quinaldines
  • {SNA} Building Blocks, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Quinaldines

相关文献及参考

  • Beil. 20 ,392
  • FT-IR 1 (2), 857:A / FT-IR 2 (3), 3908:A / FT-NMR 1 (3), 427:C / IR-Spectra (2), 1208:C / IR-Spectra (3), 1386:D / NMR-Reference 2 (2), 733:D / RegBook 1 (2), 2615:D / Structure Index 1 , 412:A:6 / Vapor Phase 3 , 1568:C

安全信息

GHS Symbol
WGK Germany3
Hazard Codes Xi
Hazard statements
  • 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
Precautionary statements
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P302+P352+P332+P313+P362+P364
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P337+P313
Signal word Warning
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
Safety Statements
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
  • 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；
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
  • S37 Wear suitable gloves 戴适当手套；
Warnings IRRITANT
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

  • Alfa Aesar:4-氯-2-甲基喹啉,97% 4-Chloro-2-methylquinoline, 97%(4295-06-1)
  • Sigma Aldrich:4295-06-1(sigmaaldrich)
  • 用途一:杀菌剂；药物中间体。
  • 下游产品:4-氨基-2-甲基可尼汀
  • 方法一:由苯胺经缩合、环合、氯化而得。1.缩合将苯胺、乙酰乙酸乙酯、苯、乙酸加入反应锅，加热回流，带出水分。当无水带出时，用常压蒸馏回收苯，再减压回收低沸物，剩余的液体即β-苯胺巴豆酸乙酯。2.环合将β-苯胺巴豆酸乙酯快速加入250-260℃的二苯醚中缩合15min，至不再有乙醇蒸出，冷至室温，加入石油醚，放置析出黄色结晶，得4-羟基喹哪啶。3.氯化将4-羟基喹哪啶与氧氯化磷混合，再加入少量五氯化磷，搅拌加热熔融。50℃时加入其余五氧化磷，搅拌反应2h，放置过夜。次日水解并加碳酸钠至碱性，析出油状物，冷却即为固体4-氯喹哪啶。
  • MOL 文件:4295-06-1.mol
  • 上游原料:盐酸 --> 二氯甲烷 --> 石油醚 --> 三氯氧磷 --> 乙酰乙酸乙酯 --> 氨基苯 --> 五氯化磷 --> 五氧化二磷 --> 二苯醚 --> 乙酰乙酸甲酯 --> 4-羟基-2-甲基喹啉 --> 巴豆酸乙酯

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. Isoquinolines 异喹啉
  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. Quinaldines 奎纳丁
  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. Quinaldines 奎纳丁
  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. Quinolines 喹啉
  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. Quinaldines - Halogenated Heterocycles
  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. Quinaldines - Halogenated Heterocycles

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