2,3-Bis[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanenitrile

Base Information

• Chemical Name: 2,3-Bis[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanenitrile
• CAS No.: 246022-09-3
• Molecular Formula: C15H7Cl2F6N3
• Molecular Weight: 414.1
• DSSTox Substance ID: DTXSID401113791
• Mol file: 246022-09-3.mol

Synonyms:246022-09-3;2,3-bis[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanenitrile;2,3-bis[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanenitrile;DTXSID401113791;AKOS005074291;10F-008;2-Pyridinepropanenitrile, 3-chloro-alpha-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-(trifluoromethyl)-

Chemical Property of 2,3-Bis[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanenitrile

Chemical Property:

• PKA: -0.38±0.32(Predicted)
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 412.9921216
• Heavy Atom Count: 26
• Complexity: 532

Purity/Quality:

95%-98% ^*data from raw suppliers

2,3-Bis[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propanenitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(C=NC(=C1Cl)CC(C#N)C2=C(C=C(C=N2)C(F)(F)F)Cl)C(F)(F)F