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CS-W001157 4
Total: USD 88.00

1-(4-Nitrophenyl)prop-2-yn-1-ol

  • CAS No. 78725-73-2

  • Cat. No. CS-0466442
  • Purity≥98%
  • MDL No.MFCD09032690

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

1-(4-Nitrophenyl)prop-2-yn-1-ol|CS-0466442

Structure of 78725-73-2

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General Information

  • CAS No. 78725-73-2
  • Cat. No. CS-0466442
  • Purity ≥98%
  • MDL No. MFCD09032690
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₃
  • Molecular Weight 177.16
  • Synonym(s) 1-(4-NITRO-PHENYL)-PROP-2-YN-1-OL
  • SMILES C#CC(C1=CC=C(C=C1)[N+](=O)[O-])O

Synthesis

  • Route1

    References

    • Salgado-Zamora, Hector; Hernandez, Jorge; Campos, Ma. Elena; Jimenez, Rogelio; Cervantes-Cuevas, Humberto; Mojica, Edna Journal fuer Praktische Chemie - Practical Applications and Applied Chemistry (Germany), 1999 , vol. 341, # 5 p. 461 - 465
  • Route2
    • null|null
      1187388-09-5
    • ~61%
    • 1-(4-Nitrophenyl)prop-2-yn-1-ol|CS-0466442
      78725-73-2

    References

    • Kolarovic, Andrej; Faberova, Zuzana Journal of Organic Chemistry, 2009 , vol. 74, # 18 p. 7199 - 7202
  • Route3

    References

    • Nilsson, Bjoern M.; Hacksell, Uli Journal of Heterocyclic Chemistry, 1989 , vol. 26, p. 269 - 275

Safety Information

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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

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Computational Chemistry Data

  • TPSA   63.37
  • LogP   1.2614
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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