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CS-W001157 4
Total: USD 88.00

5-(4-(Trifluoromethyl)phenyl)-2H-tetrazole

  • CAS No. 2251-79-8

  • Cat. No. CS-0320660
  • Purity≥98%
  • MDL No.MFCD00052525

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

5-(4-(Trifluoromethyl)phenyl)-2H-tetrazole|CS-0320660

Structure of 2251-79-8

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General Information

  • CAS No. 2251-79-8
  • Cat. No. CS-0320660
  • Purity ≥98%
  • MDL No. MFCD00052525
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₃N₄
  • Molecular Weight 214.15
  • Synonym(s) 5-[4-(Trifluoromethyl)phenyl]-1H-tetrazole
  • SMILES C1=C(C=CC(=C1)C(F)(F)F)C2=NNN=N2

Synthesis

  • Route1

    References

    • Sharghi, Hashem; Ebrahimpourmoghaddam, Sakineh; Doroodmand, Mohammad Mahdi Journal of Organometallic Chemistry, 2013 , vol. 738, p. 41 - 48
  • Route2

    References

    • Sridhar, Madabhushi; Mallu, Kishore Kumar Reddy; Jillella, Raveendra; Godala, Kondalreddy; Beeram, Chinaramanaiah; Chinthala, Narsaiah Synthesis (Germany), 2013 , vol. 45, # 4 art. no. SS-2012-Z0887-OP, p. 507 - 510

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-P370+P378

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Computational Chemistry Data

  • TPSA   54.46
  • LogP   1.8855
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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