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CS-W001157 4
Total: USD 88.00

2-Butoxybenzonitrile

  • CAS No. 6609-59-2

  • Cat. No. CS-0580440
  • Molecule weight175.23
  • Purity≥98%
  • MDL No.None

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

2-Butoxybenzonitrile|CS-0580440

Structure of 6609-59-2

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General Information

  • CAS No. 6609-59-2
  • Cat. No. CS-0580440
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃NO
  • Molecular Weight 175.23
  • Synonym(s) o-Butoxybenzonitril
  • SMILES CCCCOC1=CC=CC=C1C#N

Synthesis

  • Route1
    • null|null
      60444-92-0
    • ~84%
    • 2-Butoxybenzonitrile|CS-0580440
      6609-59-2

    References

    • Jasem, Yosef Al; Barkhad, Mohamed; Khazali, Mona Al; Butt, Hifsa Pervez; El-Khwass, Noha Ashraf; Azani, Mariam Al; Hindawi, Bassam Al; Thiemann, Thies Journal of Chemical Research, 2014 , vol. 38, # 2 p. 80 - 84
  • Route2
    • null|null
      500334-19-0
    • null|null
      140-29-4
    • ~85%
    • 2-Butoxybenzonitrile|CS-0580440
      6609-59-2

    References

    • Wen, Qiaodong; Jin, Jisong; Mei, Yuncai; Lu, Ping; Wang, Yanguang European Journal of Organic Chemistry, 2013 , # 19 p. 4032 - 4036

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   33.02
  • LogP   2.73718
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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