6-(1H-pyrazol-1-yl)nicotinonitrile

Base Information

• Chemical Name: 6-(1H-pyrazol-1-yl)nicotinonitrile
• CAS No.: 956568-52-8
• Molecular Formula: C9H6 N4
• Molecular Weight: 170.17
• Hs Code.: 29331990
• DSSTox Substance ID: DTXSID80585406
• Wikidata: Q72503649
• Mol file: 956568-52-8.mol

Synonyms:6-(1H-pyrazol-1-yl)nicotinonitrile;956568-52-8;6-pyrazol-1-ylpyridine-3-carbonitrile;6-(1H-pyrazol-1-yl)pyridine-3-carbonitrile;6-(PYRAZOL-1-YL)PYRIDINE-3-CARBONITRILE;MFCD08444474;DTXSID80585406;AKOS000198142;AC-28099;AS-61868;CS-0168319;EN300-25697;F8881-7574;Z216309416

Chemical Property of 6-(1H-pyrazol-1-yl)nicotinonitrile

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 336.437°C at 760 mmHg
• PKA: -0.79±0.19(Predicted)
• Flash Point: 157.272°C
• PSA: 54.50000
• Density: 1.23
• LogP: 1.13898
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 170.059246208
• Heavy Atom Count: 13
• Complexity: 219

Purity/Quality:

98%min ^*data from raw suppliers

6-(1H-Pyrazol-1-yl)nicotinonitrile ^*data from reagent suppliers

Safty Information:

• Statements: 20/21/22
• Safety Statements: 3/9-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN(N=C1)C2=NC=C(C=C2)C#N