5-Fluoro-1-methyl-1H-pyrazole-4-carbonitrile

Base Information

• Chemical Name: 5-Fluoro-1-methyl-1H-pyrazole-4-carbonitrile
• CAS No.: 1269293-60-8
• Molecular Formula: C5H4FN3
• Molecular Weight: 125.10
• DSSTox Substance ID: DTXSID60700115
• Wikidata: Q82631301
• Mol file: 1269293-60-8.mol

Synonyms:5-FLUORO-1-METHYL-1H-PYRAZOLE-4-CARBONITRILE;1269293-60-8;5-fluoro-1-methylpyrazole-4-carbonitrile;DTXSID60700115;AMY11974;MFCD17168486;STL589199;AKOS022172643;EN300-221691;F17323

Chemical Property of 5-Fluoro-1-methyl-1H-pyrazole-4-carbonitrile

Chemical Property:

• PKA: -2.19±0.10(Predicted)
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 125.03892530
• Heavy Atom Count: 9
• Complexity: 150

Purity/Quality:

97% ^*data from raw suppliers

5-Fluoro-1-methyl-1H-pyrazole-4-carbonitrile 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN1C(=C(C=N1)C#N)F

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