N-Methyl-5-tetrazolethiol 1-甲基-5-巯基-1H-四氮唑

CAS 13183-79-4 MFCD00037317

化学结构图

13183-79-4
SMILES: CN1N=NN=C1S

化学属性

Mol. FormulaC2H4N4S
Mol. Weight116.14
Melting Point125-128°C
TSCAYes
Density1.69
Stability对空气敏感
Boiling Point111.6±23.0°C at 760 mmHg
Flash Point21.3±22.6°C

别名和识别编码

Chemical NameN-Methyl-5-tetrazolethiol
CAS Number13183-79-4
Synonym 1-Methyl-1H-tetrazole-5-thiol {LY} 1-Methyl-1H-tetrazole-5-thiol {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-Methyl-1H-tetrazole-5-thiol {} {} {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00037317
EC Number236-132-2
PubChem Substance ID24861949
Reaxys-RN607361
Beilstein Registry Number607361
Chemical Name Translation1-甲基-5-巯基-1H-四氮唑
Wiswesser Line NotationT5NNNNJ A1 ESH
Canonical SMILESSC1=NN=NN1C
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分类

  • Sulfur & Selenium Compounds
  • Heterocycles
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Tetrazoles

产品应用

  • 用作医药中间体。

相关文献及参考

  • Kitson, T., et al.: Biochem. J., 175, 83 (1978),
  • Beilstein: 22,II,249

安全信息

RTECSXF7600000
Safety Statements
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
WGK Germany3
GHS Symbol
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
  • 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。
  • 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+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+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
  • H228 Flammable solid 易燃固体
  • 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
Signal word
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi
Packing GroupIII
UN Number 1325
Storage condition 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°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Hazard Class4.1
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 400 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD691-490

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 300 mg/kg
SEX/DURATION            : male 30 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - testes, epididymis, sperm duct
REFERENCE :
   FAATDF Fundamental and Applied Toxicology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1981-  Volume(issue)/page/year:
   8,280,1987

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 7 gm/kg
SEX/DURATION            : male 14 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - spermatogenesis (incl. genetic material,
   sperm morphology, motility, and count)
   Reproductive - Paternal Effects - testes, epididymis, sperm duct
REFERENCE :
   TJADAB Teratology, The International Journal of Abnormal Development. (Alan
   R. Liss, Inc., 41 E. 11th St., New York, NY 10003)  V.1-    1968-
   Volume(issue)/page/year: 36,467,1987

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 3100 mg/kg
SEX/DURATION            : male 31 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Paternal Effects - testes, epididymis, sperm duct
REFERENCE :
   TXAPA9 Toxicology and Applied Pharmacology.  (Academic Press, Inc., 1 E.
   First St., Duluth, MN 55802) V.1-    1959-  Volume(issue)/page/year:
   107,164,1991

其他信息

  • 易溶于水,溶于乙醇。

系列性分类


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