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CS-W001157 4
Total: USD 88.00

2-Methyl-1-(prop-2-yn-1-yl)-1h-1,3-benzodiazole

  • CAS No. 42076-29-9

  • Cat. No. CS-0258655
  • Purity95+%
  • MDL No.None

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

2-Methyl-1-(prop-2-yn-1-yl)-1h-1,3-benzodiazole|CS-0258655

Structure of 42076-29-9

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General Information

  • CAS No. 42076-29-9
  • Cat. No. CS-0258655
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₀N₂
  • Molecular Weight 170.21
  • Synonym(s) 2-Methyl-1-(prop-2-yn-1-yl)-1H-benzo[d]imidazole
  • SMILES C#CCN1C(=NC2=CC=CC=C21)C

Synthesis

  • Route1

    References

    • Galons, Herve; Bergerat, Isabelle; Combet-Farnoux, Claude; Miocque, Marcel; Decodts, Guy; Bram, Georges Journal of the Chemical Society, Chemical Communications, 1985 , p. 1730 - 1731
  • Route2
    • null|null
      198839-51-9
    • ~40%
    • null|null
      198839-60-0
    • 2-Methyl-1-(prop-2-yn-1-yl)-1h-1,3-benzodiazole|CS-0258655
      42076-29-9

    References

    • Broggini, Gianluigi; Garanti, Luisa; Molteni, Giorgio; Zecchi, Gaetano Journal of Chemical Research, Miniprint, 1997 , # 10 p. 2215 - 2226
  • Route3
    • N-(2-Nitrophenyl)acetamide|CS-0137350
      552-32-9
    • ~%
    • 2-Methyl-1-(prop-2-yn-1-yl)-1h-1,3-benzodiazole|CS-0258655
      42076-29-9

    References

    • Broggini, Gianluigi; Garanti, Luisa; Molteni, Giorgio; Zecchi, Gaetano Journal of Chemical Research, Miniprint, 1997 , # 10 p. 2215 - 2226

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-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.82
  • LogP   1.97792
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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