5-Chloro-1-methyl-4-nitroimidazole, 99.5%, reference material 5-氯-1-甲基-4-硝基咪唑

CAS 4897-25-0 MFCD00233664

化学结构图

4897-25-0
SMILES: Cn1cnc([N+](=O)[O-])c1Cl

化学属性

Mol. FormulaC4H4ClN3O2
Mol. Weight161.55
Density1.422
Melting Point148-150 °C
Appearance 白色结晶性粉末。
Boiling Point362.3±22.0 °C at 760 mmHg

别名和识别编码

Chemical Name5-Chloro-1-methyl-4-nitroimidazole, 99.5%, reference material
CAS Number4897-25-0
Alfabeta NameCHLOROMETHYLNITROIMIDAZOLE H5141-------
MDL NumberMFCD00233664
Synonym 5-Chloro-1-methyl-4-nitroimidazole {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Chloro-1-methyl-4-nitroimidazole {} {} {} {} {} {} {} {} {} {}
EC Number225-521-2
Beilstein Registry Number23(5)4,493
PubChem Substance ID21010
Reaxys-RN136775
Chemical Name Translation5-氯-1-甲基-4-硝基咪唑
Wiswesser Line NotationT5N CNJ A1 DNW EG
LabNetwork Molecule IDLN00162214
InChIInChI=1S/C4H4ClN3O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,1H3
Canonical SMILESO=[N+](C1=C(Cl)N(C)C=N1)[O-]
信息真实价格透明    资金保障    专业采购外包团队在线服务   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
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分类

  • {SNA} Building Blocks, C3 to C8, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Imidazoles
  • Heterocycles,

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany3
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
  • P362+P364
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P405 Store locked up. 上锁保管。
  • 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。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P403+P233
  • P337+P317
  • 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
  • P304+P340
  • P319
  • P305+P351+P338
  • P332+P317
  • P264+P265
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
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
RTECSNI4397100
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 10 umol/plate
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 58,1,1978

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

其他信息

  • 用途二:医药中间体。与6-巯基嘌呤缩合可得到抗肿瘤药硫唑嘌呤。
  • 5-氯-1-甲基-4-硝基咪唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C1646 5-氯-1-甲基-4-硝基咪唑 5-Chloro-1-methyl-4-nitroimidazole 5G 550元
  • 用途一:用于有机合成,是抗肿瘤药硫唑嘌呤的重要中间体
  • Acros Organics:5-氯-1-甲基-4-硝基咪唑 5-Chloro-1-methyl-4-nitroimidazole, 98%(4897-25-0)
  • TCI Shanghai:5-氯-1-甲基-4-硝基咪唑 5-Chloro-1-methyl-4-nitroimidazole,>;96.0%(N)(4897-25-0)
  • 方法一:由1-甲基-5-氯咪唑经硝化得到。将1-甲基-5-氯咪唑加入搪玻璃反应锅,然后在冷却下加入硝酸。继续在冷却下滴加硫酸,加毕,在100℃反应2h,再冷却,加入冰水析出产品,经过滤干燥得5-氯-1-甲基-4-硝基咪唑。收率为86%。
  • Sigma Aldrich:4897-25-0(sigmaaldrich)
  • MOL 文件:4897-25-0.mol
  • 上游原料:三氯氧磷 --> 五氯化磷 --> 硝酸钾 --> 搪玻璃反应锅 --> 5-氯-1-甲基咪唑 --> N,N'-二甲基草酰胺
  • 图谱信息:5-氯-1-甲基-4-硝基咪唑(4897-25-0)质谱(MS)
  • MSDS 信息:5-Chloro-1-methyl-4-nitro-1H-imidazole(4897-25-0).msds
  • 下游产品:硫唑嘌呤

系列性分类


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