3-(3-Bromophenyl)-3'-cyanopropiophenone

Base Information

• Chemical Name: 3-(3-Bromophenyl)-3'-cyanopropiophenone
• CAS No.: 898782-12-2
• Molecular Formula: C16H12BrNO
• Molecular Weight: 314.18
• DSSTox Substance ID: DTXSID701254427
• Mol file: 898782-12-2.mol

Synonyms:3-(3-bromophenyl)-3'-cyanopropiophenone;898782-12-2;3-(3-(3-Bromophenyl)propanoyl)benzonitrile;3-[3-(3-bromophenyl)propanoyl]benzonitrile;MFCD03843305;DTXSID701254427;AKOS016021297;3-[3-(3-Bromophenyl)-1-oxopropyl]benzonitrile

Chemical Property of 3-(3-Bromophenyl)-3'-cyanopropiophenone

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 313.01023
• Heavy Atom Count: 19
• Complexity: 359

Purity/Quality:

99% ^*data from raw suppliers

3-(3-bromophenyl)-3'-cyanopropiophenone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)Br)CCC(=O)C2=CC=CC(=C2)C#N

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