2-Methylthio-4-Chloro-5-Ethoxycarbonylpyrimidine 4-氯-2-甲硫基嘧啶-5-羧酸乙酯

CAS 5909-24-0 MFCD00006085

化学结构图

5909-24-0
SMILES: CCOC(=O)c1cnc(SC)nc1Cl

化学属性

Mol. FormulaC8H9ClN2O2S
Mol. Weight232.69
Melting Point60-63°C
Density1.422
TSCANo
Boiling Point335.7°C at 760 mmHg

别名和识别编码

Chemical Name2-Methylthio-4-Chloro-5-Ethoxycarbonylpyrimidine
CAS Number5909-24-0
Alfabeta NameETHYLCHLOROMETHYLTHIOPYRIMIDINECARBOXYLATE 425-----
MDL NumberMFCD00006085
Synonym Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate {} {} {} {} {} {} {}
EC Number227-619-0
Beilstein Registry Number25(4)1200
PubChem Substance ID80008
Reaxys-RN158102
Chemical Name Translation4-氯-2-甲硫基嘧啶-5-羧酸乙酯
InChIKeySNNHLSHDDGJVDM-UHFFFAOYSA-N
LabNetwork Molecule IDLN00008477
InChIInChI=1S/C8H9ClN2O2S/c1-3-13-7(12)5-4-10-8(14-2)11-6(5)9/h4H,3H2,1-2H3
Canonical SMILESO=C(OCC)C1=CN=C(SC)N=C1Cl
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分类

  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyrimidines
  • Bases & Related Reagents
  • Heterocycles
  • Nucleotides
  • Sulfur & Selenium Compounds

产品应用

  • A pyrimidine derivative as inhibitor of Streptococcus faecium, Lactobacillus casei, and Pediococcus cerevisiae.

相关文献及参考

  • Coats, E.A., et al.: Eur. J. Med. Chem., 14, 261 (1979),

安全信息

Warnings IRRITANT, KEEP COLD, STENCH
Signal word Warning
GHS Symbol
WGK Germany3
Safety Statements
  • S24 Avoid contact with skin 避免皮肤接触;
  • 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;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S37 Wear suitable gloves 戴适当手套;
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
  • 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。
  • P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
  • 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
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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。
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P332+P313
  • P333+P313
  • P337+P313
  • 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
  • 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.....
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • 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
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
Storage condition -20°C, stored under nitrogen {LY} -20°C, stored under nitrogen Keep Cold {} {LY} -20°C, stored under nitrogen {} {} {LY} -20°C, stored under nitrogen {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, stored

其他信息

  • MOL 文件:5909-24-0.mol
  • 上游原料:乙醇 --> 钠 --> 氧氯化硫 --> 三氯氧磷 --> 氢氧化钾 --> 乙酐 --> 苯 --> 原甲酸三乙酯 --> 丙二酸二乙酯 --> S-甲基异硫脲硫酸盐 --> 乙氧基甲叉丙二酸二乙酯
  • MSDS 信息:Ethyl 4-chloro-2-methylthio-5-pyrimidinecarboxylate(5909-24-0).msds
  • Sigma Aldrich:5909-24-0(sigmaaldrich)
  • 4-氯-2-甲硫基嘧啶-5-羧酸乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 E0841 4-氯-2-(甲硫基)嘧啶-5-甲酸乙酯 Ethyl 4-Chloro-2-(methylthio)pyrimidine-5-carboxylate 25G 2860元 2011/04/16 E0841 4-氯-2-(甲硫基)嘧啶-5-甲酸乙酯 Ethyl 4-Chloro-2-(methylthio)pyrimidine-5-carboxylate 5G 966元 2010/05/25 B22429 4-氯-2-甲基硫代嘧啶-5-羧酸乙酯, 98% Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate, 98% 5g 661元
  • Hazard Note:Irritant
  • Alfa Aesar:4-氯-2-甲基硫代嘧啶-5-羧酸乙酯,98% Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate, 98%(5909-24-0)
  • 检测方法:GC,NMR
  • 4-氯-2-甲硫基嘧啶-5-羧酸乙酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 E0841 4-氯-2-(甲硫基)嘧啶-5-甲酸乙酯 Ethyl 4-Chloro-2-(methylthio)pyrimidine-5-carboxylate 25G 1590元 2014/06/02 E0841 4-氯-2-(甲硫基)嘧啶-5-甲酸乙酯 Ethyl 4-Chloro-2-(methylthio)pyrimidine-5-carboxylate 5G 409元 2010/05/25 B22429 4-氯-2-甲基硫代嘧啶-5-羧酸乙酯, 98% Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate, 98% 5g 661元

系列性分类


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