Cas no 1159171-31-9 (N-Hydroxy-3,5-bis-trifluoromethyl-benzamidine)

N-Hydroxy-3,5-bis-trifluoromethyl-benzamidine structure
1159171-31-9 structure
Product Name:N-Hydroxy-3,5-bis-trifluoromethyl-benzamidine
CAS No:1159171-31-9
MF:C9H6F6N2O
MW:272.147162914276
CID:2895933
Update Time:2025-09-25

N-Hydroxy-3,5-bis-trifluoromethyl-benzamidine Chemical and Physical Properties

Names and Identifiers

    • N-Hydroxy-3,5-bis-trifluoromethyl-benzamidine
    • Benzenecarboximidamide, N'-hydroxy-3,5-bis(trifluoromethyl)-, [C(Z)]-
    • Inchi: 1S/C9H6F6N2O/c10-8(11,12)5-1-4(7(16)17-18)2-6(3-5)9(13,14)15/h1-3,18H,(H2,16,17)
    • InChI Key: GGAPMNUHESBFNK-UHFFFAOYSA-N
    • SMILES: C(C1C=C(C(=N)NO)C=C(C(F)(F)F)C=1)(F)(F)F

Computed Properties

  • Exact Mass: 272.038
  • Monoisotopic Mass: 272.038
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 302
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 58.6A^2

N-Hydroxy-3,5-bis-trifluoromethyl-benzamidine Pricemore >>

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