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CS-W001157 4
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2-Methyl-2-(p-tolyl)propanenitrile

  • CAS No. 40119-34-4

  • Cat. No. CS-M0468
  • Purity≥95%
  • MDL No.MFCD11036610

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

2-Methyl-2-(p-tolyl)propanenitrile|CS-M0468

Structure of 40119-34-4

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General Information

  • CAS No. 40119-34-4
  • Cat. No. CS-M0468
  • Purity ≥95%
  • MDL No. MFCD11036610
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃N
  • Molecular Weight 159.23
  • Synonym(s) 2-Methyl-2-p-tolylpropanenitrile
  • SMILES N#CC(C)(C)C(C=C1)=CC=C1C

Synthesis

  • Route1

    References

    • Yamashita, Makoto; Ono, Yujirou; Tawada, Hiroyuki Tetrahedron, 2004 , vol. 60, # 12 p. 2843 - 2849
  • Route2

    References

    • Lambert; Rose; Weedon Journal of the Chemical Society, 1949 , p. 42,46
  • Route3
    • null|null
      78-82-0
    • ~%
    • 2-Methyl-2-(p-tolyl)propanenitrile|CS-M0468
      40119-34-4
    • 2-Methyl-2-(m-tolyl)propanenitrile|CS-0517302
      30568-27-5
    • 2-Methyl-2-(o-tolyl)propanenitrile|CS-0662178
      30568-28-6

    References

    • Jackson, W. Roy; Rae, Ian D.; Wong, Margaret G. Australian Journal of Chemistry, 1986 , vol. 39, # 2 p. 303 - 315

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.7962
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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