2-Isopropyl-6-methyl-4-pyrimidone 2-异丙基-6-甲基-4-嘧啶醇

CAS 2814-20-2 MFCD00044811

化学结构图

2814-20-2
SMILES: Cc1cc(=O)[nH]c(C(C)C)n1

化学属性

Mol. FormulaC8H12N2O
Mol. Weight152.19368
Melting Point172-175 °C
Appearance 本品为白色结晶，m.p.172～175℃，不溶于水。
Boiling Point274.67 °C at 760 mmHg

别名和识别编码

Chemical Name2-Isopropyl-6-methyl-4-pyrimidone
MDL NumberMFCD00044811
PubChem Substance ID135444498
CAS Number2814-20-2
EC Number220-561-7
Synonym 2-Isopropyl-6-methyl-4pyrimidinol {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Isopropyl-6-methyl-4pyrimidinol {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation2-异丙基-6-甲基-4-嘧啶醇
Wiswesser Line NotationT6N CNJ BY1&1 DQ F1
LabNetwork Molecule IDLN00226368
InChIInChI=1S/C8H12N2O/c1-5(2)8-9-6(3)4-7(11)10-8/h4-5H,1-3H3,(H,9,10,11)
Canonical SMILESO=C1N=C(C(C)C)NC(C)=C1
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分类

  • {Chemicalbook} 农药中间体: 杀虫剂中间体: 有机磷类杀虫剂
  • Alpha sort, Alphabetic, Analytical Standards, Analytical/Chromatography, Chromatography, Diazinon metabolites, Environmental Standards, H-M, I, Metabolites, Pesticides & Metabolites
  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Heterocyclic Building Blocks, Pyrimidines

相关文献及参考

  • FT-NMR 1 (3), 364:B / RegBook 1 (2), 2565:H / Structure Index 1 , 405:A:6

安全信息

Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • 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
RTECSUW7525000
GHS Symbol
Signal word Warning
Hazard Codes Xi
WGK Germany2
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
  • 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。
  • P302+P352
  • 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。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • 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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
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；
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
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
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2200 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 52(3),69,1987

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2700 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JAFCAU Journal of Agricultural and Food Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC
   20037)  V.1-    1953-  Volume(issue)/page/year: 18,208,1970

Storage condition

其他信息

  • 上游原料:异丁醛 --> 异丁腈 --> 丁脒 --> 双二甲胺基乙基醚
  • MOL 文件:2814-20-2.mol
  • 用途三:有机磷农药二嗪磷、医药中间体。
  • 用途一:用作医药中间体
  • 用途二:2-异丙基-4-甲基-6-羟基嘧啶是杀虫剂二嗪磷的中间体。
  • Sigma Aldrich:2814-20-2(sigmaaldrich)
  • 2-异丙基-6-甲基-4-吡啶醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 134480100 2-异丙基-6-甲基-4-吡啶醇 2-Isopropyl-6-methyl-4-pyrimidinol 99% 10 GR 423元
  • 方法一:其制备方法是由异丁醛制得的异丁腈与甲醇、氯化氢反应，制成亚胺醚盐酸盐。反应方程式如下： 由亚胺醚盐酸盐与氨反应生成异丁脒，再与乙酰乙酸乙酯在氢氧化钠存在下环合生成2-异丙基-4-甲基-6-羟基嘧啶。
  • Acros Organics:2-异丙基-6-甲基-4-嘧啶醇 2-Isopropyl-6-methyl-4-pyrimidinol, 99%(2814-20-2)
  • 下游产品:嘧啶氧磷 --> 二嗪农

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Alphabetic - Analytical Standards
  4. I - Alphabetic
  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. Pyrimidines 嘧啶
  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Standards
  3. Chromatography - Analytical Standards
  4. Environmental Standards - Chromatography
  5. Pesticides & Metabolites - Environmental Standards
  6. Alpha sort - Pesticides & Metabolites
  7. H-M - Alpha sort
  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. Pyrimidines 嘧啶
  5. C6 to C8 - Pyrimidines