4,5-Diphenyl-1H-Imidazole-2-Thiol 4,5-二苯基-1H-咪唑-2-硫醇

CAS 2349-58-8 MFCD00005189

化学结构图

2349-58-8
SMILES: S=c1[nH]c(-c2ccccc2)c(-c2ccccc2)[nH]1

化学属性

Mol. FormulaC15H12N2S
Mol. Weight252.33
Melting Point>300 °C
Boiling Point407.5±55.0 °C at 760 mmHg

别名和识别编码

Chemical Name4,5-Diphenyl-1H-Imidazole-2-Thiol
CAS Number2349-58-8
Alfabeta NameDIPHENYLIMIDAZOLYLHYDROSULFIDE H4512-----,
MDL NumberMFCD00005189
PubChem Substance ID679479
Beilstein Registry Number187613
EC Number219-077-9
Synonym 4,5-Diphenyl-1H-imidazole-2-thiol {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} { {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imidazole-2-thiol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,5-Diphenyl-1H-imida
Chemical Name Translation4,5-二苯基-1H-咪唑-2-硫醇
InChIKeyGMTAWLUJHGIUPU-UHFFFAOYSA-N
LabNetwork Molecule IDLN00147705
InChIInChI=1S/C15H12N2S/c18-15-16-13(11-7-3-1-4-8-11)14(17-15)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18)
Canonical SMILESC1=CC=C(C=C1)C2=C(C3=CC=CC=C3)N=C(N2)S
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分类

  • {SNA} Building Blocks, C9 to C30+, Chemical Synthesis, Heterocyclic Building Blocks, Imidazoles
  • {KO} Thiols
  • {SA} Building Blocks, C9 to C30+, Chemical Synthesis, Heterocyclic Building Blocks, Imidazoles
  • {KO} AminesSecondaryHeteroNH

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Safety Statements
  • 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；
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Donors
2
H-bond Acceptors
1
Rotatable Bonds
2
LogP
4

其他信息

  • 4,5-二苯基-2-咪唑硫醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 155960050 4,5-Diphenyl-2-imidazolethiol 97% 5 GR 741元 2010/06/21 155960250 4,5-Diphenyl-2-imidazolethiol 97% 25 GR 2804元
  • Sigma Aldrich:2349-58-8(sigmaaldrich)
  • MOL 文件:2349-58-8.mol
  • 上游原料:硫氰酸铵 --> 2-羟基-2-苯基苯乙酮
  • Acros Organics:4,5-Diphenyl-2-imidazolethiol, 97%(2349-58-8)

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. Imidazoles 咪唑
  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

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