5-Aminopyrimidine-2,4,6(1H,3H,5H)-Trione 5-氨基嘧啶-2,4,6(1H,3H,5H)-三酮

CAS 118-78-5 MFCD00023873

化学结构图

118-78-5
SMILES: NC1C(=O)NC(=O)NC1=O

化学属性

Mol. FormulaC4H5N3O3
Mol. Weight143.10
Appearance 2-氨基巴比土酸 (118-78-5)为白色粉末状晶体。熔点>;400℃。溶于热水。
Melting Point399.85 °C
Boiling Point261.16 °C at 760 mmHg

别名和识别编码

Chemical Name5-Aminopyrimidine-2,4,6(1H,3H,5H)-Trione
Synonym 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Aminopyrimidine-2,4,6(1H,3H,5H)-trione {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Aminopyrimidin
MDL NumberMFCD00023873
CAS Number118-78-5
Alfabeta NameAMINOPYRIMIDINETRIONEURAMIL HHH5246135(())---,,,,
Reaxys-RN6178
PubChem Substance ID87561913
Merck Number9852
Chemical Name Translation5-氨基嘧啶-2,4,6(1H,3H,5H)-三酮
EC Number204-277-0
LabNetwork Molecule IDLN00180344
InChIInChI=1S/C4H5N3O3/c5-1-2(8)6-4(10)7-3(1)9/h1H,5H2,(H2,6,7,8,9,10)
Canonical SMILESO=C1NC(C(C(N1)=O)N)=O
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分类

  • {uni_hamburg} no charge; nitrogen heterocycle; alicycle; 6RingOnly; 6ring; urea; amide; lactame; 1fragment

相关文献及参考

  • Short: III/20a Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei D ... Cl Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20a Year: 1988 Keyword: NQR ISBN: 3-540-18161-X ISBN: 978-3-540-18161-3 Internet Resource: DOI:10.1007/b31153 RefComment: IX,677 pages. Hardcover Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

Warnings IRRITANT
Signal word
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
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。
  • 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+P350
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • 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
  • 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
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Safety Statements
  • 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；
  • 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；
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
GHS Symbol
Storage condition

其他信息

  • 上游原料:巴比妥酸
  • 图谱信息:2-氨基巴比土酸 (118-78-5)红外图谱(IR1) 2-氨基巴比土酸 (118-78-5)红外图谱(IR2)
  • Sigma Aldrich:118-78-5(sigmaaldrich)
  • 用途一:用于有机合成。
  • 方法一:由2-硝基巴比土酸还原得到。
  • TCI Shanghai:2-氨基巴比土酸 Uramil,>;95.0%(N)(118-78-5)
  • MOL 文件:118-78-5.mol

系列性分类

  1. Functional Group 官能团索引
  2. carboxylic acid imide, N-unsubstituted

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