1H-Imidazole-4-Carboxylic Acid 4-咪唑甲酸

CAS 1072-84-0 MFCD00082203

化学结构图

1072-84-0
SMILES: O=C(O)c1c[nH]cn1

化学属性

Mol. FormulaC4H4N2O2
Mol. Weight112.09
Density1.524
Melting Point294-295°C
TSCANo
Boiling Point495°C at 760 mmHg

别名和识别编码

Chemical Name1H-Imidazole-4-Carboxylic Acid
CAS Number1072-84-0
Alfabeta NameIMIDAZOLECARBOXYLICACID H14---
MDL NumberMFCD00082203
EC Number214-017-8
Beilstein Registry Number25(3/4)720
PubChem Substance ID14080
Synonym 1H-Imidazole-4-carboxylic acid {LY} 1H-Imidazole-4-carboxylic acid {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-Imidazole-4-carboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1H-I
Reaxys-RN2626
Chemical Name Translation4-咪唑甲酸
InChIKeyNKWCGTOZTHZDHB-UHFFFAOYSA-N
Wiswesser Line NotationT5M CNJ DVQ
LabNetwork Molecule IDLN00002169
InChIInChI=1S/C4H4N2O2/c7-4(8)3-1-5-2-6-3/h1-2H,(H,5,6)(H,7,8)
Canonical SMILESC1=C(C(=O)O)[NH]C=N1
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分类

  • {SNA} Building Blocks, C3 to C8, Chemical Synthesis, Heterocyclic Building Blocks, Imidazoles

产品应用

  • 用于合成咪唑类功能化的聚（丙烯亚胺）树枝状结构。

相关文献及参考

  • Beilstein:25(3/4)720

安全信息

Warnings IRRITANT
Signal word
GHS Symbol
WGK Germany3
Safety Statements
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
  • 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 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
  • 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。
  • 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
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P332+P313
  • P302+P352
  • P305+P351+P338+P337+P313
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
RTECSNI4001000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
Storage condition 2-8°C {LY} 2-8°C Refrigerator 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 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1650 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   PBPHAW Progress in Biochemical Pharmacology.  (S. Karger AG, Postfach
   CH-4009 Basel, Switzerland) V.1-    1965-  Volume(issue)/page/year:
   1,542,1965

其他信息

  • 图谱信息:1H-咪唑-4-甲酸(1072-84-0)质谱(MS) 1H-咪唑-4-甲酸(1072-84-0)红外图谱(IR2) 1H-咪唑-4-甲酸(1072-84-0)红外图谱(IR1)
  • 外观:淡黄色至类白色粉末。
  • 用途一:用于合成咪唑类功能化的聚（丙烯亚胺）树枝状结构。
  • TCI Shanghai:4-咪唑甲酸 4-Imidazolecarboxylic Acid,>;98.0%(LC)(1072-84-0)
  • Acros Organics:1H-Imidazole-4-carboxylic acid, 98%(1072-84-0)
  • 上游原料:硫酸 --> 乙酐 --> 原甲酸三乙酯 --> 苯甲醚 --> 咪唑-4,5-二羧酸 --> 2,3-二氨基-2-丁烯二腈
  • Hazard Note:Irritant
  • MOL 文件:1072-84-0.mol
  • Sigma Aldrich:1072-84-0(sigmaaldrich)
  • 下游产品:1-三苯甲基-1H-咪唑-4-羧酸
  • 1H-咪唑-4-甲酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0607 4-咪唑甲酸 4-Imidazolecarboxylic Acid 5G 1930元 2014/06/02 I0607 4-咪唑甲酸 4-Imidazolecarboxylic Acid 1G 616元 2010/06/21 397110010 1H-咪唑-4-甲酸 1H-Imidazole-4-carboxylic acid 98% 1 GR 764元

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. Imidazoles 咪唑
  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. Imidazoles 咪唑
  5. C3 to C8 - Imidazoles
  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. Heterocyclic Acids 杂环酸
  5. Imidazole Acids

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