5-(4-amino-2,6-difluorophenyl)-1-methyl-1H-pyrrole-2-carbonitrile

Base Information

• Chemical Name: 5-(4-amino-2,6-difluorophenyl)-1-methyl-1H-pyrrole-2-carbonitrile
• CAS No.: 922506-34-1
• Molecular Formula: C12H9F2N3
• Molecular Weight: 233.21700
• DSSTox Substance ID: DTXSID60581567
• Wikidata: Q82472748

Synonyms:5-(4-amino-2,6-difluorophenyl)-1-methyl-1H-pyrrole-2-carbonitrile;922506-34-1;SCHEMBL4599028;DTXSID60581567;IXOGTWWGFMXXIT-UHFFFAOYSA-N

Chemical Property of 5-(4-amino-2,6-difluorophenyl)-1-methyl-1H-pyrrole-2-carbonitrile

Chemical Property:

• Boiling Point: 358.6±42.0 °C(Predicted)
• PSA: 54.74000
• Density: 1.30±0.1 g/cm3(Predicted)
• LogP: 3.00538
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 233.07645362
• Heavy Atom Count: 17
• Complexity: 315

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=CC=C1C2=C(C=C(C=C2F)N)F)C#N

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