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CS-W001157 4
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3-(1-(4-Chlorophenyl)-3-oxobutan-2-yl)benzonitrile

  • CAS No. 848311-03-5

  • Cat. No. CS-M0876
  • Purity≥97%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-(1-(4-Chlorophenyl)-3-oxobutan-2-yl)benzonitrile|CS-M0876

Structure of 848311-03-5

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General Information

  • CAS No. 848311-03-5
  • Cat. No. CS-M0876
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₄ClNO
  • Molecular Weight 283.75
  • Synonym(s) Benzonitrile,3-[1-[(4-chlorophenyl)methyl]-2-oxopropyl]
  • SMILES N#CC1=CC=CC(C(CC(C=C2)=CC=C2Cl)C(C)=O)=C1

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   40.86
  • LogP   4.12698
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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