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5-(2-Methoxyphenyl)-1h-1,2,3,4-tetrazole

  • CAS No. 51449-81-1

  • Cat. No. CS-0217641
  • Purity≥98%
  • MDL No.None

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

5-(2-Methoxyphenyl)-1h-1,2,3,4-tetrazole|CS-0217641

Structure of 51449-81-1

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General Information

  • CAS No. 51449-81-1
  • Cat. No. CS-0217641
  • Purity ≥98%
  • MDL No. None
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₄O
  • Molecular Weight 176.18
  • Synonym(s) 5-(2-Methoxyphenyl)-1H-Tetrazole
  • SMILES COC1=CC=CC=C1C2=NNN=N2

Synthesis

  • Route1

    References

    • Norman, Derek P. G.; Bunnell, Aaron E.; Stabler, S. Russell; Flippin, Lee A. Journal of Organic Chemistry, 1999 , vol. 64, # 25 p. 9301 - 9306
  • Route2

    References

    • Herbst; Wilson Journal of Organic Chemistry, 1957 , vol. 22, p. 1142,1145
  • Route3
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    • In-stock
      5-(2-Methoxyphenyl)-1h-1,2,3,4-tetrazole|CS-0217641
      51449-81-1

    References

    • Herbst; Wilson Journal of Organic Chemistry, 1957 , vol. 22, p. 1142,1145

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS07
Signal Word : Danger
UN#: 1325
Class : 4.1
Packing Group : Ⅲ
Hazard Statements : H228-H315-H319
Precautionary Statements : P210-P240-P241-P264-P280-P302+P352-P362+P364-P370+P378

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Computational Chemistry Data

  • TPSA   63.69
  • LogP   0.8753
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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