4-Cyano-3-fluorophenyl 4-(5-butylpyrimidin-2-yl)benzoate

Base Information

• Chemical Name: 4-Cyano-3-fluorophenyl 4-(5-butylpyrimidin-2-yl)benzoate
• CAS No.: 106533-86-2
• Molecular Formula: C22H18FN3O2
• DSSTox Substance ID: DTXSID10602791
• Wikidata: Q82499973

Synonyms:106533-86-2;SCHEMBL10668653;4-Cyano-3-fluorophenyl 4-(5-butylpyrimidin-2-yl)benzoate;DTXSID10602791

Chemical Property of 4-Cyano-3-fluorophenyl 4-(5-butylpyrimidin-2-yl)benzoate

Chemical Property:

• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 375.13830499
• Heavy Atom Count: 28
• Complexity: 547

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F

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