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CS-W001157 4
Total: USD 88.00

2-Allylbenzonitrile

  • CAS No. 61463-61-4

  • Cat. No. CS-0267267
  • Purity95+%
  • MDL No.None

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

2-Allylbenzonitrile|CS-0267267

Structure of 61463-61-4

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General Information

  • CAS No. 61463-61-4
  • Cat. No. CS-0267267
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉N
  • Molecular Weight 143.19
  • Synonym(s) 3-(2-Cyanophenyl)prop-1-ene
  • SMILES C=CCC1=CC=CC=C1C#N

Synthesis

  • Route1

    References

    • Perichon, Jacques; Gosmini, Corinne; Bastienne, Mylene; Gomes, Paulo Patent: US2004/186328 A1, 2004 ; Location in patent: Page 13-14 ;
  • Route2
    • null|null
      2042-37-7
    • null|null
      106-95-6
    • ~80%
    • 2-Allylbenzonitrile|CS-0267267
      61463-61-4

    References

    • Julian, Lisa D.; Hartwig, John F. Journal of the American Chemical Society, 2010 , vol. 132, # 39 p. 13813 - 13822
  • Route3
    • null|null
      591-87-7
    • null|null
      2042-37-7
    • ~64%
    • In-stock
      2-(2-Cyanophenyl)benzonitrile|CS-0204949
      4341-02-0
    • 2-Allylbenzonitrile|CS-0267267
      61463-61-4
    • null|null
      100-47-0

    References

    • Perichon, Jacques; Gosmini, Corinne; Bastienne, Mylene; Gomes, Paulo Patent: US2004/186328 A1, 2004 ; Location in patent: Page 12-13 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.28678
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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