5-chloro-1-(pyridin-2-yl)-1H-pyrazole-4-carbonitrile

Base Information

• Chemical Name: 5-chloro-1-(pyridin-2-yl)-1H-pyrazole-4-carbonitrile
• CAS No.: 104771-35-9
• Molecular Formula: C9H5ClN4
• Molecular Weight: 204.62
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID10600479
• Wikidata: Q72458772
• Mol file: 104771-35-9.mol

Synonyms:5-chloro-1-(pyridin-2-yl)-1H-pyrazole-4-carbonitrile;104771-35-9;5-Chloro-1-pyridin-2-ylpyrazole-4-carbonitrile;SCHEMBL10517284;DTXSID10600479;AKOS015899760;DS-6688;DB-059191;CS-0060618;W16942

Chemical Property of 5-chloro-1-(pyridin-2-yl)-1H-pyrazole-4-carbonitrile

Chemical Property:

• Boiling Point: 395 °C at 760 mmHg
• Flash Point: 192.7 °C
• PSA: 54.50000
• Density: 1.39 g/cm³
• LogP: 1.79238
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 204.0202739
• Heavy Atom Count: 14
• Complexity: 248

Purity/Quality:

98%min ^*data from raw suppliers

5-Chloro-1-(pyridin-2-yl)-1H-pyrazole-4-carbonitrile 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)N2C(=C(C=N2)C#N)Cl