2-(Cyanomethyl)benzimidazole 2-氰甲基苯并咪唑

CAS 4414-88-4 MFCD00005601

化学结构图

4414-88-4
SMILES: N#CCc1nc2ccccc2[nH]1

化学属性

Mol. FormulaC9H7N3
Mol. Weight157.17
Density1.295
Melting Point210-215°C
TSCAYes
Appearance 棕色颗粒或粉末
Boiling Point439.5°C at 760 mmHg

别名和识别编码

Chemical Name2-(Cyanomethyl)benzimidazole
CAS Number4414-88-4
Alfabeta NameBENZIMIDAZOLYLACETONITRILE H12---
MDL NumberMFCD00005601
EC Number224-574-9
Beilstein Registry Number128461
Synonym (2-Benzimidazolyl)acetonitrile {LY} (2-Benzimidazolyl)acetonitrile {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (2-Benzimidazolyl)acetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} (2-B
PubChem Substance ID20455
Reaxys-RN128461
Chemical Name Translation2-氰甲基苯并咪唑
InChIKeyBWOVACANEIVHST-UHFFFAOYSA-N
Wiswesser Line NotationT56 BM DNJ C1CN
LabNetwork Molecule IDLN00221680
InChIInChI=1S/C9H7N3/c10-6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5H2,(H,11,12)
Canonical SMILESC1=CC=CC2=C1[NH]C(=N2)CC#N
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分类

  • {SNA} Benzimidazoles, Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks
  • {SNA} Chemical Synthesis, Chromates, Oxidizing Agents, Synthetic Reagents

相关文献及参考

  • Beilstein:25(5)4,286

安全信息

Warnings IRRITANT
Signal word
GHS Symbol
WGK Germany3
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；
  • 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
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
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。
  • P304+P340+P312
  • 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。
  • 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。
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • P302+P352+P312+P362+P364
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H302+H312+H332
  • H332 Harmful if inhaled 吸入有害
  • H315 Causes skin irritation 会刺激皮肤
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H319 Causes serious eye irritation 严重刺激眼睛
RTECSDD5650000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xn
Packing GroupIII
Hazard Class6.1
UN Number 3276 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#04148

TYPE OF TEST            : Sex chromosome loss and nondisjunction
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 250 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 343,185,1995

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

  • 储运特性:通风低温干燥; 与库房食品原料分开存放
  • 可燃性危险特性:可燃; 燃烧产生有毒氮氧化物烟雾
  • 毒性分级:高毒
  • MSDS 信息:2-Benzimidazolylacetonitrile(4414-88-4).msds
  • Sigma Aldrich:4414-88-4(sigmaaldrich)
  • 2-氰甲基苯并咪唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B2821 (2-苯并咪唑基)乙腈 (2-Benzimidazolyl)acetonitrile 5G 345元 2014/06/02 B2821 (2-苯并咪唑基)乙腈 (2-Benzimidazolyl)acetonitrile 25G 1180元 2010/05/25 L00827 2-苯并咪唑基乙腈, 99% 2-Benzimidazoleacetonitrile, 99% 2g 220元
  • Alfa Aesar:2-苯并咪唑基乙腈,99% 2-Benzimidazoleacetonitrile, 99%(4414-88-4)
  • MOL 文件:4414-88-4.mol
  • 下游产品:香豆素 7 --> 香豆素 30 --> 溶剂红 196 --> 溶剂红 197
  • 灭火剂:干粉,泡沫,沙土,二氧化碳, 雾状水
  • Acros Organics:2-(Cyanomethyl)benzimidazole, 99%(4414-88-4)
  • 用途一:用于合成染料、颜料等
  • TCI Shanghai:(2-苯并咪唑基)乙腈 (2-Benzimidazolyl)acetonitrile,>;96.0%(GC)(4414-88-4)
  • 急性毒性:静脉-小鼠 LD50: 56 毫克/公斤
  • 类别:有毒物品

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. Benzimidazoles 苯并咪唑
  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. Imidazoles 咪唑
  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Oxidation - Synthetic Reagents
  4. Chromates - Oxidation

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