5-Iodouracil 5-碘尿嘧啶

CAS 696-07-1 MFCD00006020

化学结构图

696-07-1
SMILES: O=c1[nH]cc(I)c(=O)[nH]1

化学属性

Mol. FormulaC4H3IN2O2
Mol. Weight237.98
Melting Point274-276°C
Density1.422
TSCAYes
SolubilitySOLUBLE IN COLD WATER
Stability对光敏感
pH:A

别名和识别编码

Chemical Name5-Iodouracil
Synonym 5-Iodouracil {LY} 5-Iodouracil {} {LY} 5-Iodouracil {} {} {LY} 5-Iodouracil {} {} {} {LY} 5-Iodouracil {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Iodouracil {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00006020
PubChem Substance ID69672
CAS Number696-07-1
EC Number211-788-2
Beilstein Registry Number4891
Chemical Name Translation5-碘尿嘧啶
Reaxys-RN4891
Wiswesser Line NotationT6MVMVJ FI
InChIInChI=1S/C4H3IN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)
LabNetwork Molecule IDLN00173183
Canonical SMILESO=C1NC(C(I)=CN1)=O
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分类

  • Building Blocks, C4 to C5, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyrimidines
  • {SNA} Building Blocks, C4 to C5, Chemical Synthesis, Halogenated Heterocycles, Heterocyclic Building Blocks, Pyrimidines

相关文献及参考

  • Beil. 24 ,320
  • FT-IR 2 (3), 3830:C / FT-IR 1 (2), 810:B / FT-NMR 1 (3), 363:B / IR-Spectra (3), 1354:B / IR-Spectra (2), 1179:D / NMR-Reference 2 (2), 692:A / RegBook 1 (2), 2565:F / Sax 6 , 1623 / Sigma FT-IR 1 (1), 1002:B / Structure Index 1 , 405:C:5
  • For a review of the use of uracils as starting materials in heterocyclic synthesis, see: Adv. Het. Chem., 55, 130 (1992).

安全信息

WGK Germany3
GHS Symbol
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+P352+P312+P362+P364
  • P304+P340+P312
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Hazard statements
  • H302+H312+H332
  • H332 Harmful if inhaled 吸入有害
  • H315 Causes skin irritation 会刺激皮肤
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H319 Causes serious eye irritation 严重刺激眼睛
Hazard Codes T T,Xi
RTECSYR0525000
Personal Protective Equipment Eyeshields, Gloves, type P2 (EN 143) respirator cartridges
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • 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；
  • S36/37/39 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；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
  • S53 Avoid exposure - obtain special instructions before use 避免接触，使用前获得特别指示说明；
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
  • R46 May cause inheritable genetic damage 可能引起遗传基因损害
Storage condition 2-8°C, protect from light {LY} 2-8°C, protect from light Light Sensitive {} {LY} 2-8°C, protect from light {} {} {LY} 2-8°C, protect from light {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, protect from light {} {} {} {} {} {} {} {} {} {} {} {}
UN Number 2811 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 300 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BCPCA6 Biochemical Pharmacology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958-  Volume(issue)/page/year:
   13,1249,1964

其他信息

  • MSDS 信息:2,4-Dihydroxy-5-iodopyrimidine(696-07-1).msds
  • 图谱信息:5-碘尿嘧啶(696-07-1)红外图谱(IR2) 5-碘尿嘧啶(696-07-1)红外图谱(IR1) 5-碘尿嘧啶(696-07-1)核磁图( 13 CNMR) 5-碘尿嘧啶(696-07-1)质谱(MS)
  • Alfa Aesar:5-碘尿嘧啶,97% 5-Iodouracil, 97%(696-07-1)
  • TCI Shanghai:5-碘尿嘧啶 5-Iodouracil,>;99.0%(LC)(T)(696-07-1)
  • 5-碘尿嘧啶价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0219 5-碘尿嘧啶 5-Iodouracil 5G 241元 2014/06/02 I0219 5-碘尿嘧啶 5-Iodouracil 25G 700元 2010/06/21 228160500 5-碘尿嘧啶 5-Iodouracil 99% 50 GR 3746元
  • MOL 文件:696-07-1.mol
  • Acros Organics:5-碘尿嘧啶 5-Iodouracil, 99%(696-07-1)
  • 检测方法:HPLC
  • Hazard Note:Irritant/Carcinogenic/Light Sensitive
  • 敏感性:Light Sensitive
  • 存储注意事项:光敏感
  • Sigma Aldrich:696-07-1(sigmaaldrich)

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
  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. Halogenated Heterocycles 卤代杂环
  5. Pyrimidines - Halogenated Heterocycles
  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. Halogenated Heterocycles 卤代杂环
  5. Pyrimidines - Halogenated Heterocycles
  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. C4 to C5 - Pyrimidines
  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. Halogenated Heterocycles 卤代杂环
  5. Pyridines
  1. C9 to C46

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