1H-1,2,4-Triazole-3-Thiol 1H-1,2,4-三氮唑-3-硫醇

CAS 3179-31-5 MFCD00005229

化学结构图

3179-31-5
SMILES: Sc1nc[nH]n1

化学属性

Mol. FormulaC2H3N3S
Mol. Weight101.13
Melting Point217-224°C
TSCAYes
Density1.73
Appearance 白色结晶。熔点221-222℃。
Boiling Point132.6±23.0 °C at 760 mmHg

别名和识别编码

Chemical Name1H-1,2,4-Triazole-3-Thiol
MDL NumberMFCD00005229
CAS Number3179-31-5
Synonym 3-Mercapto-1,2,4-triazole {LY} 3-Mercapto-1,2,4-triazole {} {LY} 3-Mercapto-1,2,4-triazole {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Mercapto-1,2,4-triazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Merca
PubChem Substance ID2723802
Beilstein Registry Number107731
EC Number221-656-6
Reaxys-RN507153
Chemical Name Translation1H-1,2,4-三氮唑-3-硫醇
Wiswesser Line NotationT5MN DNJ CSH
LabNetwork Molecule IDLN00194547
InChIInChI=1S/C2H3N3S/c6-2-3-1-4-5-2/h1H,(H2,3,4,5,6)
Canonical SMILESS=C1NNC=N1
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分类

  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Triazoles

产品应用

  • 医药中间体、照相显影剂、防锈添加剂。

相关文献及参考

  • Beilstein:26,142

安全信息

WGK Germany1
RTECSXZ5267500
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;
  • S33 Take precautionary measures against static discharges 对静电采取预防措施;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置;
  • 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;
  • S7/8 Keep container tightly closed and dry 保存在严格密闭容器中,保持干燥;
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36 Irritating to eyes 刺激眼睛
GHS Symbol
Precautionary statements
  • 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。
  • P302+P350
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xn Xn,Xi Xi
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 180 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#03630

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1400 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 21,284,1971

Storage condition 2-8°C {LY} 2-8°C 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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°

其他信息

  • 3-巯基-1,2,4-三氮唑价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010182 3-巯基-1,2,4-三氮唑 25g 300元 2011/04/16 M0814 3-巯基-1,2,4-三唑 3-Mercapto-1,2,4-triazole 25G 697元 2011/04/16 M0814 3-巯基-1,2,4-三唑 3-Mercapto-1,2,4-triazole 500G 5590元
  • Hazard Note:Irritant
  • 用途一:用作医药中间体、照相显影剂、防锈添加剂等
  • Alfa Aesar:3-硫基-1,2,4-三唑,98% 3-Mercapto-1,2,4-triazole, 98%(3179-31-5)
  • Acros Organics:1氢-1,2,4-三氮唑-3-硫醇 1H-1,2,4-Triazole-3-thiol, 97%(3179-31-5)
  • F:10-23
  • Sigma Aldrich:3179-31-5(sigmaaldrich)
  • 海关编码:29339990
  • 可溶于水和乙醇,常温常压不易分解。
  • 用途二:医药中间体、照相显影剂、防锈添加剂。
  • TCI Shanghai:3-巯基-1,2,4-三唑 3-Mercapto-1,2,4-triazole,>;97.0%(GC)(T)(3179-31-5)
  • MSDS 信息:1,2,4-Triazole-3(5)-thiol(3179-31-5).msds
  • 图谱信息:3-巯基-1,2,4-三氮唑(3179-31-5)红外图谱(IR1) 3-巯基-1,2,4-三氮唑(3179-31-5)核磁图( 13 CNMR) 3-巯基-1,2,4-三氮唑(3179-31-5)红外图谱(IR2) 3-巯基-1,2,4-三氮唑(3179-31-5)质谱(MS) 3-巯基-1,2,4-三氮唑(3179-31-5)核磁图( 1 HNMR)
  • MOL 文件:3179-31-5.mol

系列性分类


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