4-(2-(S)-Ethyl-piperidin-1-yl)-2-trifluoromethyl-benzonitrile

Base Information

• Chemical Name: 4-(2-(S)-Ethyl-piperidin-1-yl)-2-trifluoromethyl-benzonitrile
• CAS No.: 869643-05-0
• Molecular Formula: C15H17F3N2
• DSSTox Substance ID: DTXSID10468374

Synonyms:4-(2-(S)-Ethyl-piperidin-1-yl)-2-trifluoromethyl-benzonitrile;869643-05-0;SCHEMBL4902580;DTXSID10468374

Chemical Property of 4-(2-(S)-Ethyl-piperidin-1-yl)-2-trifluoromethyl-benzonitrile

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 282.13438304
• Heavy Atom Count: 20
• Complexity: 371

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CCC1CCCCN1C2=CC(=C(C=C2)C#N)C(F)(F)F
• Isomeric SMILES: CC[C@H]1CCCCN1C2=CC(=C(C=C2)C#N)C(F)(F)F

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