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CS-W001157 4
Total: USD 88.00

(5S)-5,6-Dihydro-5-(1-methylpropyl)-2-(2,3,4,5,6-pentafluorophenyl)-8H-1,2,4-triazolo[3,4-c][1,4]oxazinium tetrafluoroborate

  • CAS No. 1449522-21-7

  • Cat. No. CS-0087932
  • Purity≥98%
  • MDL No.None

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

(5S)-5,6-Dihydro-5-(1-methylpropyl)-2-(2,3,4,5,6-pentafluorophenyl)-8H-1,2,4-triazolo[3,4-c][1,4]oxazinium tetrafluoroborate|CS-0087932

Structure of 1449522-21-7

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General Information

  • CAS No. 1449522-21-7
  • Cat. No. CS-0087932
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₅BF₉N₃O
  • Molecular Weight 435.10
  • Synonym(s) (5S)-5-(sec-butyl)-2-(perfluorophenyl)-2,5,6,8-tetrahydro-[1,2,4]triazolo[3,4-c][1,4]oxazin-4-ium tetrafluoroborate
  • SMILES FC1=C(F)C(F)=C(F)C(F)=C1[N+]2=CN3[C@@H]([C@H](C)CC)COCC3=N2.FB(F)F.[F-]

Safety Information

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GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

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Computational Chemistry Data

  • TPSA   30.93
  • LogP   0.8565
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   3

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