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


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