7H-Pyrrolo[2,3-d]pyrimidin-4-ol 4-羟基吡咯并[2,3-d]嘧啶

CAS 3680-71-5 MFCD01686814

化学结构图

3680-71-5
SMILES: O=c1[nH]cnc2[nH]ccc12

化学属性

Mol. FormulaC6H5N3O
Mol. Weight135.12
Melting Point345-348°C
Boiling Point473°C at 760 mmHg

别名和识别编码

Chemical Name1,7-Dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
MDL NumberMFCD08234923
CAS Number3680-71-5
Chemical Name Translation4-羟基吡咯并[2,3-d]嘧啶
Synonym 7-Deazahypoxanthine {LY} 7-Deazahypoxanthine {} {LY} 7-Deazahypoxanthine {} {} {LY} 7-Deazahypoxanthine {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Deazahypoxanthine {} {} {} {} {} {} {} {} {} {}
Beilstein Registry Number607869
InChIKeyFBMZEITWVNHWJW-UHFFFAOYSA-N
PubChem Substance ID135408689
InChIInChI=1S/C6H5N3O/c10-6-4-1-2-7-5(4)8-3-9-6/h1-3H,(H2,7,8,9,10)
Canonical SMILESOC1=C2C=CNC2=NC=N1
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安全信息

Hazard Codes Xi
Signal word Warning
GHS Symbol
WGK Germany3
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；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
Risk Statements
  • R36 Irritating to eyes 刺激眼睛
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
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
  • 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
  • P305+P351+P338
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P317
  • P333+P313
  • P333+P317
  • P337+P313
  • P337+P317
  • P362+P364
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • 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
Storage condition 2-8°C {LY} 2-8°C Store at room temperature {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°

其他信息

  • 下游产品:4-氯吡咯并嘧啶
  • 上游原料:钠 --> 碳酸钾 --> 氯化铵 --> 氰乙酸乙酯 --> 硫脲 --> 碘化钠 --> 2-溴-1,1-二乙氧基乙烷 --> 铝镍合金
  • MOL 文件:3680-71-5.mol

系列性分类

  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

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