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CS-W001157 4
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4-Hydroxy-3-isopropylbenzonitrile

  • CAS No. 46057-54-9

  • Cat. No. CS-0201376
  • Purity≥98%
  • MDL No.None

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

4-Hydroxy-3-isopropylbenzonitrile|CS-0201376

Structure of 46057-54-9

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General Information

  • CAS No. 46057-54-9
  • Cat. No. CS-0201376
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO
  • Molecular Weight 161.20
  • Synonym(s) 4-hydroxy-3-propan-2-ylbenzonitrile
  • SMILES N#CC1=CC=C(O)C(C(C)C)=C1

Synthesis

  • Route1
    • In-stock
      4-Bromo-2-propan-2-ylphenol|CS-0008502
      26307-50-6
    • null|null
      557-21-1
    • ~60%
    • In-stock
      4-Hydroxy-3-isopropylbenzonitrile|CS-0201376
      46057-54-9

    References

    • Pei, Zhonghua; Li, Xiaofeng; Longenecker, Kenton L.; Sham, Hing L.; Wiedeman, Paul E. Patent: US2005/131019 A1, 2005 ; Location in patent: Page/Page column 48 ; US 20050131019 A1

Safety Information

Download SDS
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

Quality Control

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Computational Chemistry Data

  • TPSA   44.02
  • LogP   2.38728
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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