1,1-Thiocarbonyldiimidazole 1,1-硫羰基二咪唑

CAS 6160-65-2 MFCD00005289

化学结构图

6160-65-2
SMILES: S=C(n1ccnc1)n1ccnc1

化学属性

Mol. FormulaC7H6N4S
Mol. Weight178.21
Melting Point98-102°C
TSCANo
Solubility分解
Density1.39
Stability对湿度敏感
Boiling Point390.8°C at 760 mmHg

别名和识别编码

Chemical Name1,1-Thiocarbonyldiimidazole
CAS Number6160-65-2
Alfabeta NameTHIOCARBONYLDIIMIDAZOLE 11-,'
MDL NumberMFCD00005289
Synonym Thiocarbonyldiimidazole {LY} Thiocarbonyldiimidazole {} {LY} Thiocarbonyldiimidazole {} {} {LY} Thiocarbonyldiimidazole {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Thiocarbonyldiimidazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY}
EC Number228-183-4
Beilstein Registry Number609349
PubChem Substance ID87566387
Chemical Name Translation1,1-硫羰基二咪唑
Reaxys-RN609349
InChIKeyRAFNCPHFRHZCPS-UHFFFAOYSA-N
LabNetwork Molecule IDLN00174471
Canonical SMILESS=C(N1C=CN=C1)N2C=CN=C2
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分类

  • Sulfur & Selenium Compounds
  • Heterocycles
  • Amines
  • {SNA} Building Blocks, C3 to C8, Carbonyldiimidazole Derivatives, Chemical Synthesis, Coupling, Heterocyclic Building Blocks, Imidazoles, Synthetic Reagents
  • {SNA} Carbonyldiimidazole Derivatives, Chemical Synthesis, Coupling, Synthetic Reagents

产品应用

  • 合成硫代酰胺的试剂；从醇中制备硫代甲酸酯，期间要和Bu3SnH-AIBN3剧烈反应。

相关文献及参考

  • Reacts with diols to give cyclic thionocarbonates which are desulfurized by trialkyl phosphites to give alkenes by cis-elimination of CO2 from the intermediate carbene (Corey-Winter olefination): J. Am. Chem. Soc., 85, 2677 (1963); Angew. Chem. Int. Ed., 14, 753 (1975). For a modified procedure involving ring-opening of the thionocarbonate intermediate with an alkyl iodide, followed by Zn reduction of the resulting iodo ester, see: Tetrahedron Lett., 3793 (1973). Alternatively, the thionocarbonate of a 1,2-diol can be selectively reduced to the methylenedioxy group with Triphenyl­tin hydride, L00163, under free-radical conditions: J. Org. Chem., 62, 4159 (1997).
  • Can be used to deoxygenate carbocyclic monosaccharide analogues: Tetrahedron., 48, 2349 (1992).
  • Loke, I., et al.: Tetrahedron, 68,?697 (2012),

安全信息

Warnings IRRITANT, STORED UNDER ARGON
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；
  • S22 Do not breathe dust 不要吸入粉尘；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Risk Statements
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen Moisture Sensitive {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sto
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Signal word
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
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。
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
  • P301+P312
  • P305+P351+P338
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P301+P330+P331
Hazard Codes Xi
GHS Symbol

其他信息

  • 溶于水并分解。
  • Alfa Aesar:1,1'-硫代碳酰基二咪唑,tech.90% 1,1'-Thiocarbonyldiimidazole, tech 90%(6160-65-2)
  • F:9-21
  • 敏感性:Moisture Sensitive
  • 用途一:用于生化合成反应中基团保护及蛋白质肽链的连接
  • Hazard Note:Irritant/Keep Cold/Moisture Sensitive
  • 用途二:合成硫代酰胺的试剂；从醇中制备硫代甲酸酯，期间要和Bu3SnH-AIBN3剧烈反应。
  • Acros Organics:1,1'-硫代羰酰二咪唑 1,1'-Thiocarbonyldiimidazole, tech., 90%(6160-65-2)
  • Sigma Aldrich:6160-65-2(sigmaaldrich)
  • N,N'-硫羰基二咪唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010109 1，1-硫代羰基二咪唑 10g 600元 2011/04/16 C1376 1,1'-硫羰基二咪唑 1,1'-Thiocarbonyldiimidazole 5G 1020元 2011/04/16 C1376 1,1'-硫羰基二咪唑 1,1'-Thiocarbonyldiimidazole 25G 3050元
  • TCI Shanghai:1,1'-硫羰基二咪唑 1,1'-Thiocarbonyldiimidazole,>;95.0%(T)(6160-65-2)
  • MOL 文件:6160-65-2.mol
  • MSDS 信息:1,1'-Thiocarbonylbis(imidazole)(6160-65-2).msds

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. Homopiperidines 同哌啶
  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. Imidazoles 咪唑
  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Coupling - Synthetic Reagents
  4. Carbodiimides - Coupling
  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Coupling - Synthetic Reagents
  4. Carbonyldiimidazole Derivatives - Coupling
  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

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