N-(pyridin-2-yl)pyridine-2-carbothioamide

Base Information

• Chemical Name: N-(pyridin-2-yl)pyridine-2-carbothioamide
• CAS No.: 39122-38-8
• Molecular Formula: C₁₁H₉N₃S
• Molecular Weight: 215.279
• NSC Number: 185058
• DSSTox Substance ID: DTXSID80353743
• Nikkaji Number: J264.518A
• ChEMBL ID: CHEMBL112597
• Mol file: 39122-38-8.mol

Synonyms:NSC185058

Chemical Property of N-(pyridin-2-yl)pyridine-2-carbothioamide

Chemical Property:

• Vapor Pressure: 6.41E-06mmHg at 25°C
• Boiling Point: 378.2°Cat760mmHg
• Flash Point: 182.5°C
• Density: 1.323g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 215.05171847
• Heavy Atom Count: 15
• Complexity: 220

Purity/Quality:

99.3% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)C(=S)NC2=CC=CC=N2

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