1H-imidazole-4-carbaldehyde 1H-imidazole-4-carbaldehyde

CAS 3034-50-2 MFCD00173726

化学结构图

3034-50-2
SMILES: O=Cc1c[nH]cn1

化学属性

Mol. FormulaC4H4N2O
Mol. Weight96.09
Density1.422
Melting Point174-177°C
TSCANo
Stability对空气敏感
Appearance 类白色结晶粉末,熔点174-177℃
Boiling Point367.8°C at 760 mmHg

别名和识别编码

Chemical Name1H-imidazole-4-carbaldehyde
CAS Number3034-50-2
Alfabeta NameIMIDAZOLECARBALDEHYDE 4--
MDL NumberMFCD00173726
EC Number221-227-3
Beilstein Registry Number24(5)2,93
Synonym 1H-Imidazole-5-carboxaldehyde {LY} 1H-Imidazole-5-carboxaldehyde {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-5-carboxaldehyde
PubChem Substance ID76428
Reaxys-RN1715
Chemical Name Translation1H-imidazole-4-carbaldehyde
InChIKeyZQEXIXXJFSQPNA-UHFFFAOYSA-N
LabNetwork Molecule IDLN00003464
InChIInChI=1S/C4H4N2O/c7-2-4-1-5-3-6-4/h1-3H,(H,5,6)
Canonical SMILESO=CC1=CNC=N1
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分类

  • {SNA} Aldehydes, Building Blocks, C1 to C6, C3 to C8, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Imidazoles, Organic Building Blocks

产品应用

  • 实际合成强效 C17,20-裂解酶抑制剂的原料。裂解酶是雄激素生物合成的关键酶,也是治疗雄激素依赖性前列腺癌的药物靶标。
  • 用于合成强效的抗疟疾药。

安全信息

Warnings IRRITANT
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 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
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • 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。
  • 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。
  • P305+P351+P338
  • 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
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
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Storage condition -20°C, sealed storage, away from moisture {LY} -20°C, sealed storage, away from moisture 0-10 0-10°C Air Sensitive Store at room temperature {} {LY} -20°C, sealed storage, away from moisture {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {LY} -20°C, sealed storage, away from
Hazard Codes Xn Xi Xi,Xn

其他信息

  • 上游原料:盐酸 --> 乙醚 --> N,N-二甲基甲酰胺 --> 碳酸钠 --> 乙酐 --> 三乙胺 --> 氢氧化铵 --> 氨 --> 苯 --> 氯化铵 --> 1,4-二氧六环 --> 甲醛 --> 异丙醇 --> 镁 --> 亚硫酸钠 --> 二氧化锰 --> 碘 --> 溴乙烷 --> 硫酸铜 --> 氢硫酸 --> 咪唑 --> 苦味酸 --> D-(-)-果糖 --> 咪唑-4,5-二羧酸 --> 三苯基氯甲烷
  • 下游产品:
  • Alfa Aesar:咪唑-4-甲醛,97% Imidazole-4-carboxaldehyde, 97%(3034-50-2)
  • 敏感性:Air Sensitive
  • MOL 文件:3034-50-2.mol
  • 4-咪唑甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0636 咪唑-4-甲醛 Imidazole-4-carboxaldehyde 1G 325元 2014/06/02 I0636 咪唑-4-甲醛 Imidazole-4-carboxaldehyde 5G 883元 2010/06/21 CC08804EB 4-咪唑甲醛 1H-imidazole-4-carbaldehyde 25 GR 3075元
  • Hazard Note:Irritant
  • Sigma Aldrich:3034-50-2(sigmaaldrich)
  • Acros Organics:1H-Imidazole-4-carbaldehyde, 97%(3034-50-2)
  • TCI Shanghai:咪唑-4-甲醛 Imidazole-4-carboxaldehyde,>;98.0%(GC)(3034-50-2)

系列性分类


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