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CS-W001157 4
Total: USD 88.00

2-Ethynyl-4-methylaniline

  • CAS No. 215589-37-0

  • Cat. No. CS-0158574
  • Purity≥95%
  • MDL No.MFCD11036439

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

2-Ethynyl-4-methylaniline|CS-0158574

Structure of 215589-37-0

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General Information

  • CAS No. 215589-37-0
  • Cat. No. CS-0158574
  • Purity ≥95%
  • MDL No. MFCD11036439
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉N
  • Molecular Weight 131.17
  • Synonym(s) ethynylmethylaniline
  • SMILES C#CC1=C(C=CC(=C1)C)N

Synthesis

  • Route1
    • null|null
      180624-14-0
    • ~93%
    • 2-Ethynyl-4-methylaniline|CS-0158574
      215589-37-0

    References

    • State of Oregon, acting by and through the State Board of Higher Education on Behalf of University; Johnson, Darren W.; Carroll, Calden; Haley, Michael M.; Engle, Jeff Patent: US2014/31559 A1, 2014 ; Location in patent: Paragraph 0272 ;
  • Route2

    References

    • Gabriele, Bartolo; Salerno, Giuseppe; Veltri, Lucia; Costa, Mirco; Massera, Chiara European Journal of Organic Chemistry, 2001 , # 24 p. 4607 - 4613
  • Route3

    References

    • Sakai, Norio; Tamura, Kosuke; Shimamura, Kazuyori; Ikeda, Reiko; Konakahara, Takeo Organic Letters, 2012 , vol. 14, # 3 p. 836 - 839

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   26.02
  • LogP   1.55852
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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