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CS-W001157 4
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3-(3-Cyanopropanoyl)benzonitrile

  • CAS No. 898767-58-3

  • Cat. No. CS-0579118
  • Molecule weight184.19
  • Purity≥98%
  • MDL No.None

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

3-(3-Cyanopropanoyl)benzonitrile|CS-0579118

Structure of 898767-58-3

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General Information

  • CAS No. 898767-58-3
  • Cat. No. CS-0579118
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈N₂O
  • Molecular Weight 184.19
  • Synonym(s) 4-(3-Cyanophenyl)-4-oxobutyronitrile
  • SMILES N#CCCC(C1=CC=CC(C#N)=C1)=O

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   64.65
  • LogP   2.04476
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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