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5-(Bromomethyl)isoxazole

  • CAS No. 69735-35-9

  • Cat. No. CS-D0211
  • Purity≥97%
  • MDL No.MFCD08669517

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

5-(Bromomethyl)isoxazole|CS-D0211

Structure of 69735-35-9

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General Information

  • CAS No. 69735-35-9
  • Cat. No. CS-D0211
  • Purity ≥97%
  • MDL No. MFCD08669517
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₄BrNO
  • Molecular Weight 161.98
  • Synonym(s) Isoxazole, 5-(bromomethyl)- (9CI)
  • SMILES BrCC1=CC=NO1

Synthesis

  • Route1

    References

    • DeShong; Cipollina; Lowmaster Journal of Organic Chemistry, 1988 , vol. 53, # 7 p. 1356-1364
  • Route2

    References

    • Clark, Thomas Jeffrey Patent: US2002/160998 A1, 2002 ;
  • Route3

    References

    • Archiv der Pharmazie, , vol. 332, # 1 p. 7 - 12

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3265
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P405-P501

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Computational Chemistry Data

  • TPSA   26.03
  • LogP   1.5695
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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