5-(Pyridin-4-YL)-1H-imidazole-2-thiol

Base Information

• Chemical Name: 5-(Pyridin-4-YL)-1H-imidazole-2-thiol
• CAS No.: 146366-04-3
• Molecular Formula: C8H7N3S
• Molecular Weight: 177.23
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID70434095
• Wikidata: Q82248414
• Pharos Ligand ID: RVJNPU17Z1F1
• ChEMBL ID: CHEMBL406800
• Mol file: 146366-04-3.mol

Synonyms:146366-04-3;5-(PYRIDIN-4-YL)-1H-IMIDAZOLE-2-THIOL;4-pyridin-4-yl-1,3-dihydroimidazole-2-thione;SB-379278A;CHEMBL406800;4-(Pyridin-4-yl)-1,3-dihydro-2H-imidazole-2-thione;SCHEMBL4874412;SCHEMBL15568639;DTXSID70434095;KQGPQDMPQIWCMX-UHFFFAOYSA-N;AM751;BDBM50372468;SB379278A;AKOS015898456;AKOS040749426;4-Pyridin-4-yl-1H-imidazole-2-thiol;5-(Pyridin-4-l)-1H-midazole-2-hiol;PD129777;FT-0659021;4-(4-pyridyl)-1,3-dihydroimidazole-2-thione;A808493

Chemical Property of 5-(Pyridin-4-YL)-1H-imidazole-2-thiol

Chemical Property:

• Boiling Point: 333.119 °C at 760 mmHg
• Flash Point: 155.265 °C
• PSA: 80.37000
• Density: 1.39 g/cm³
• LogP: 1.76040
• Storage Temp.: 2-8°C
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 177.03606841
• Heavy Atom Count: 12
• Complexity: 218

Purity/Quality:

97% ^*data from raw suppliers

5-(PYRIDIN-4-YL)-1H-IMIDAZOLE-2-THIOL 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CN=CC=C1C2=CNC(=S)N2