2,3-Dimethoxybenzonitrile 2,3-二甲氧基苯甲腈

CAS 5653-62-3 MFCD00001784

化学结构图

5653-62-3
SMILES: COc1cccc(C#N)c1OC

化学属性

Mol. FormulaC9H9NO2
Mol. Weight163.18
Melting Point43-46°C
Flash Point113°C
TSCANo
Boiling Point264.5°C at 760 mmHg
Density1.12
Appearance 白色晶体。熔点68-70℃。

别名和识别编码

Chemical Name2,3-Dimethoxybenzonitrile
MDL NumberMFCD00001784
CAS Number5653-62-3
EC Number227-097-4
Synonym 2,3-Dimethoxybenzonitrile {LY} 2,3-Dimethoxybenzonitrile {} {LY} 2,3-Dimethoxybenzonitrile {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxyben
Beilstein Registry Number2719631
Chemical Name Translation2,3-二甲氧基苯甲腈
Wiswesser Line NotationNCR BO1 CO1
InChIKeyLBXGBNHUNHWYRM-UHFFFAOYSA-N
PubChem Substance ID21862
LabNetwork Molecule IDLN01317375
InChIInChI=1S/C9H9NO2/c1-11-8-5-3-4-7(6-10)9(8)12-2/h3-5H,1-2H3
Canonical SMILESN#CC1=CC=CC(OC)=C1OC
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分类

  • {SNA} Building Blocks, C8 to C9, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks

安全信息

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。
  • P264+P265
  • 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+P312
  • P301+P317
  • P302+P352
  • P304+P312
  • P304+P340
  • P305+P351+P338
  • 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。
  • P317
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P322 Specific measures (see …on this label). 具体治疗(见本标签上的)。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • 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 Warning
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H302+H312+H332
  • H312 Harmful in contact with skin 皮肤接触有害
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H332 Harmful if inhaled 吸入有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
RTECSDI4355000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Safety Statements
  • S9 Keep container in a well-ventilated place 保持容器在通风良好的场所;
  • 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;
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
Packing GroupIII
UN Number 3276 UN3439
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
Hazard Codes Xn Xn,T
Hazard Class6.1
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#04768

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

  • MOL 文件:5653-62-3.mol
  • MOL 文件:2024-83-1.mol
  • 2,3-二甲氧基苯甲腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 B20942 2,3-二甲氧基苯甲腈, 98% 2,3-Dimethoxybenzonitrile, 98% 50g 2940元 2010/05/25 B20942 2,3-二甲氧基苯甲腈, 98% 2,3-Dimethoxybenzonitrile, 98% 10g 692元
  • 3,4-二甲氧基苄腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D2870 3,4-二甲氧基苯甲腈 3,4-Dimethoxybenzonitrile 25G 701元 2010/06/21 115470250 3,4-二甲氧基苄腈 3,4-Dimethoxybenzonitrile 97% 25 GR 612元 2010/05/25 A12521 3,4-二甲氧基苯甲腈, 98+% 3,4-Dimethoxybenzonitrile, 98+% 25g 528元
  • 图谱信息:3,4-二甲氧基苄腈(2024-83-1)核磁图( 1 HNMR) 3,4-二甲氧基苄腈(2024-83-1)核磁图( 13 CNMR) 3,4-二甲氧基苄腈(2024-83-1)红外图谱(IR2) 3,4-二甲氧基苄腈(2024-83-1)红外图谱(IR1) 3,4-二甲氧基苄腈(2024-83-1)Raman光谱 3,4-二甲氧基苄腈(2024-83-1)质谱(MS)
  • Alfa Aesar:2,3-二甲氧基苯甲腈,98% 2,3-Dimethoxybenzonitrile, 98%(5653-62-3)
  • Sigma Aldrich:5653-62-3(sigmaaldrich)
  • 用途一:有机合成中间体。
  • TCI Shanghai:3,4-二甲氧基苯甲腈 3,4-Dimethoxybenzonitrile,>;98.0%(GC)(2024-83-1)
  • Acros Organics:3,4-二甲氧基苄腈 3,4-Dimethoxybenzonitrile, 97%(2024-83-1)
  • Sigma Aldrich:2024-83-1(sigmaaldrich)
  • 上游原料:盐酸羟胺 --> 3,4-二甲氧基苯甲醛肟
  • Alfa Aesar:3,4-二甲氧基苯甲腈,98+% 3,4-Dimethoxybenzonitrile, 98+%(2024-83-1)
  • 方法一:由3,4-二甲氧基苯甲醛肟和乙酐反应得到。3,4-二甲氧基苯甲醛肟可由3,4-二甲氧基苯甲醛和盐酸羟胺反应得到。

系列性分类


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