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2-(4-Hydroxyphenyl)-2-methylpropanenitrile

  • CAS No. 55770-61-1

  • Cat. No. CS-0136786
  • Purity≥96%
  • MDL No.None

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

2-(4-Hydroxyphenyl)-2-methylpropanenitrile|CS-0136786

Structure of 55770-61-1

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General Information

  • CAS No. 55770-61-1
  • Cat. No. CS-0136786
  • Purity ≥96%
  • MDL No. None
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁NO
  • Molecular Weight 161.20
  • Synonym(s) 2-(4-Hydroxy-phenyl)-2-Methyl-propionitrile
  • SMILES N#CC(C)(C)C1=CC=C(O)C=C1

Synthesis

  • Route1

    References

    • ELI LILLY AND COMPANY Patent: WO2004/26305 A1, 2004 ; Location in patent: Page/Page column 109-110 ; WO 2004/026305 A1
  • Route2
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      210551-82-9
    • ~%
    • In-stock
      2-(4-Hydroxyphenyl)-2-methylpropanenitrile|CS-0136786
      55770-61-1

    References

    • MERCK and CO., INC. Patent: WO2009/140163 A1, 2009 ; Location in patent: Page/Page column 36 ; WO 2009/140163 A1
  • Route3
    • null|null
      108-95-2
    • ~%
    • In-stock
      2-(4-Hydroxyphenyl)-2-methylpropanenitrile|CS-0136786
      55770-61-1

    References

    • The Dow Chemical Company Patent: US4916251 A1, 1990 ;

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   44.02
  • LogP   2.19338
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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