Cas no 1079039-19-2 (5-Bromo-2,4-dinitrobenzaldehyde)

5-Bromo-2,4-dinitrobenzaldehyde structure
1079039-19-2 structure
Product Name:5-Bromo-2,4-dinitrobenzaldehyde
CAS No:1079039-19-2
MF:C7H3BrN2O5
MW:275.013120889664
CID:2124778
Update Time:2023-08-03

5-Bromo-2,4-dinitrobenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 5-bromo-2,4-dinitrobenzaldehyde
    • RHBYFCYFCRTTKQ-UHFFFAOYSA-N
    • 5-Bromo-2,4-dinitrobenzaldehyde
    • Inchi: 1S/C7H3BrN2O5/c8-5-1-4(3-11)6(9(12)13)2-7(5)10(14)15/h1-3H
    • InChI Key: RHBYFCYFCRTTKQ-UHFFFAOYSA-N
    • SMILES: BrC1=CC(C=O)=C(C=C1[N+](=O)[O-])[N+](=O)[O-]

Computed Properties

  • Exact Mass: 273.923
  • Monoisotopic Mass: 273.923
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 286
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 109
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