3-[4-Chloro-2-(2-chlorobenzoyl)phenyl]prop-2-enenitrile

Base Information

• Chemical Name: 3-[4-Chloro-2-(2-chlorobenzoyl)phenyl]prop-2-enenitrile
• CAS No.: 81993-03-5
• Molecular Formula: C16H9Cl2NO
• Molecular Weight: 302.15500
• DSSTox Substance ID: DTXSID40706291

Synonyms:81993-03-5;3-[4-Chloro-2-(2-chlorobenzoyl)phenyl]prop-2-enenitrile;DTXSID40706291;CQSGINBFYDVOOQ-UHFFFAOYSA-N;3-[2-(2-chlorobenzoyl)-4-chlorophenyl]-2-propenenitrile

Chemical Property of 3-[4-Chloro-2-(2-chlorobenzoyl)phenyl]prop-2-enenitrile

Chemical Property:

• PSA: 40.86000
• LogP: 4.76118
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 301.0061193
• Heavy Atom Count: 20
• Complexity: 425

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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