2-Chloropyrimidine 2-氯嘧啶

CAS 1722-12-9 MFCD00006060

化学结构图

1722-12-9
SMILES: Clc1ncccn1

化学属性

Mol. FormulaC4H3ClN2
Mol. Weight114.53
Boiling Point199.2°C at 760 mmHg
Melting Point63-66°C
Flash Point98°C
TSCANo
Density1.422
Appearance 黄色结晶。熔点60-64℃。 闪点 98°C ;
Stability对热、湿度和空气敏感

别名和识别编码

Chemical Name2-Chloropyrimidine
CAS Number1722-12-9
PubChem Substance ID74404
EC Number217-020-2
Beilstein Registry Number107171
MDL NumberMFCD00006060
Reaxys-RN107171
Synonym 2-Chloropyrimidine {LY} 2-Chloropyrimidine {} {LY} 2-Chloropyrimidine {} {} {LY} 2-Chloropyrimidine {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Chloropyrimidine {} {} {} {} {}
Alfabeta NameCHLOROPYRIMIDINE 2-
Chemical Name Translation2-氯嘧啶
InChIKeyUNCQVRBWJWWJBF-UHFFFAOYSA-N
LabNetwork Molecule IDLN00008389
InChIInChI=1S/C4H3ClN2/c5-4-6-2-1-3-7-4/h1-3H
Canonical SMILESClC1=NC=CC=N1
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分类

  • Building Blocks, C4 to C5, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyrimidines
  • {uni_hamburg} no charge; nitrogen heterocycle; aromatic; 6RingOnly; 6ring; 1fragment
  • {SNA} Building Blocks, C4 to C5, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyrimidines

产品应用

  • It was used in the synthesis of:
  • novel bis(2-(pyrimidin-2-yl)ethoxy)alkanes;
  • 4′-(1,1′-(5-(2-methoxyphenoxy)-[2,2′-bipyrimidine]-4,6-diyl)bis(1H-pyrazol-3,1-diyl)) dianiline fluorescent dye, biosensor for protein assay;
  • cis- and trans-octahydropyrrolo[2,3]pyridine derivatives;
  • 2-amino-4-heteroarylpyrimidines

相关文献及参考

  • Organolithium reagents add to the 1,6-imine bond, giving, after aromatization with DDQ, 6-substituted 2-chloropyrimidines: J. Org. Chem., 53, 4137 (1988).
  • Short: III/20a
  • Short: III/31a
  • Alkoxylation with 3-butyn-1-ol, followed by intramolecular Diels-Alder reaction, leads to a fused pyridine system, by a sequence analogous to that shown for 2-Chloropyrazine, A10108: Tetrahedron, 45, 803 (1989). For a similar sequence using the anion of an alkynylmalononitrile, see: Tetrahedron, 45, 5151 (1989). For synthesis of a benzofuropyridine by the cyclization of a 2-(alkynylphenoxy)pyrimidine, see: Tetrahedron, 45, 6511 (1989).

安全信息

GHS Symbol
WGK Germany3
Hazard Codes 6.1 Xn Xn,Xi
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H301 Toxic if swallowed 吞食有毒
  • H302+H312+H332
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
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。
  • 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
  • P301+P312+P330
  • P302+P352+P312+P362+P364
  • P304+P340+P312
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Storage condition Store at room temperature, keep dry and cool {LY} Store at room temperature, keep dry and cool {} {LY} Store at room temperature, keep dry and cool {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature,
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;
UN Number 2811
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36 Irritating to eyes 刺激眼睛
  • R36/37 Irritating to eyes and respiratory system 对眼睛和呼吸系统有刺激性
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
Packing GroupIII
Warnings IRRITANT
Hazard Class6.1(b)

其他信息

  • 2-氯嘧啶价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C1050 2-氯嘧啶 2-Chloropyrimidine 25G 560元 2010/06/21 185840500 2-氯嘧啶 2-Chloropyrimidine 98+% 50 GR 2441元 2010/06/21 185840100 2-氯嘧啶 2-Chloropyrimidine 98+% 10 GR 682元
  • 图谱信息:2-氯嘧啶(1722-12-9)质谱(MS) 2-氯嘧啶(1722-12-9)核磁图( 13 CNMR) 2-氯嘧啶(1722-12-9)核磁图( 1 HNMR) 2-氯嘧啶(1722-12-9)红外图谱(IR2) 2-氯嘧啶(1722-12-9)红外图谱(IR1)
  • TCI Shanghai:2-氯嘧啶 2-Chloropyrimidine,>;99.0%(GC)(1722-12-9)
  • MOL 文件:1722-12-9.mol
  • 敏感性:Moisture Sensitive
  • 下游产品:丁螺环酮 --> 盐酸丁螺环酮 --> 2-(三丁基锡)嘧啶 --> 5-溴-2-(哌嗪-1-基)嘧啶 --> 2-1-哌啶吡啶酮 --> 5-溴-2-(哌啶-1-基)嘧啶 --> 5-溴-2-(吗啉-4-基)嘧啶
  • Alfa Aesar:2-氯嘧啶,98% 2-Chloropyrimidine, 98%(1722-12-9)
  • F:10-23
  • Hazard Note:Irritant
  • Acros Organics:2-氯嘧啶 2-Chloropyrimidine, 98+%(1722-12-9)
  • Sigma Aldrich:1722-12-9(sigmaaldrich)
  • MSDS 信息:2-Chloropyrimidine(1722-12-9).msds
  • 检测方法:GC,NMR
  • 用途一:用作药物丁螺环酮中间体

系列性分类


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