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CS-W001157 4
Total: USD 88.00

4-Butylbenzonitrile

  • CAS No. 20651-73-4

  • Cat. No. CS-0186971
  • Purity≥98%
  • MDL No.None

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

4-Butylbenzonitrile|CS-0186971

Structure of 20651-73-4

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General Information

  • CAS No. 20651-73-4
  • Cat. No. CS-0186971
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃N
  • Molecular Weight 159.23
  • Synonym(s) 4-n-Butylbenzonitrile
  • SMILES CCCCC1=CC=C(C=C1)C#N

Synthesis

  • Route1

    References

    • Kataoka, Noriyasu; Shelby, Quinetta; Stambuli, James P.; Hartwig, John F. Journal of Organic Chemistry, 2002 , vol. 67, # 16 p. 5553 - 5566
  • Route2
    • 4-(4-Cyanophenyl)-1-butene|CS-0710177
      15451-33-9
    • ~85%
    • In-stock
      4-Butylbenzonitrile|CS-0186971
      20651-73-4
    • null|null
      100-46-9

    References

    • Maegawa, Tomohiro; Fujita, Yuki; Sakurai, Ai; Akashi, Akira; Sato, Mutsumi; Oono, Keiji; Sajiki, Hironao Chemical and Pharmaceutical Bulletin, 2007 , vol. 55, # 5 p. 837 - 839
  • Route3
    • null|null
      109-72-8
    • null|null
      6638-68-2
    • null|null
      138373-10-1
    • ~0%
    • In-stock
      [1,1'-Biphenyl]-4-carbonitrile|CS-W017260
      2920-38-9
    • In-stock
      4-Butylbenzonitrile|CS-0186971
      20651-73-4

    References

    • Kobayashi, Yuichi; William, Anthony D.; Mizojiri, Ryo Journal of Organometallic Chemistry, 2002 , vol. 653, # 1-2 p. 91 - 97

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H302+H312+H332-H315-H319-H335
Precautionary Statements : P210-P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P370+P378-P403-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.90088
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   3

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