3-(Pyridin-2-yl)-1H-indole-2-carbonitrile

Base Information

• Chemical Name: 3-(Pyridin-2-yl)-1H-indole-2-carbonitrile
• CAS No.: 65076-79-1
• Molecular Formula: C14H9N3
• Molecular Weight: 219.24100
• DSSTox Substance ID: DTXSID90702122
• Nikkaji Number: J23.958E
• Wikidata: Q82633931
• Mol file: 65076-79-1.mol

Synonyms:65076-79-1;3-(Pyridin-2-yl)-1H-indole-2-carbonitrile;3-(2-Pyridyl)-1H-indole-2-carbonitrile;DTXSID90702122

Chemical Property of 3-(Pyridin-2-yl)-1H-indole-2-carbonitrile

Chemical Property:

• Boiling Point: 499.1±40.0 °C(Predicted)
• PKA: 12.50±0.30(Predicted)
• PSA: 52.47000
• Density: 1.31±0.1 g/cm3(Predicted)
• LogP: 3.10158
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 219.079647300
• Heavy Atom Count: 17
• Complexity: 319

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=C(N2)C#N)C3=CC=CC=N3