2-Chloropyrimidine 2-氯嘧啶
CAS 1722-12-9 MFCD00006060
化学结构图
SMILES: Clc1ncccn1
化学属性
| Mol. Formula | C4H3ClN2 |
|---|---|
| Mol. Weight | 114.53 |
| Boiling Point | 199.2°C at 760 mmHg |
| Melting Point | 63-66°C |
| Flash Point | 98°C |
| TSCA | No |
| Density | 1.422 |
| 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 Name | 2-Chloropyrimidine |
|---|---|
| CAS Number | 1722-12-9 |
| PubChem Substance ID | 74404 |
| EC Number | 217-020-2 |
| Beilstein Registry Number | 107171 |
| MDL Number | MFCD00006060 |
| Reaxys-RN | 107171 |
| 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 Name | CHLOROPYRIMIDINE 2- |
| Chemical Name Translation | 2-氯嘧啶 |
| InChIKey | UNCQVRBWJWWJBF-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00008389 |
| InChI | InChI=1S/C4H3ClN2/c5-4-6-2-1-3-7-4/h1-3H |
| Canonical SMILES | ClC1=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
- 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
- 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.....
- 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；
- 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
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
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