3,5-dinitrosalicylic acid

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 52
Total Number of Articles : 50
PubChem 11873
Molecular Formula

C7H4N2O7

SMILES

C1=C(C=C(C(=C1C(=O)O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H4N2O7/c10-6-4(7(11)12)1-3(8(13)14)2-5(6)9(15)16/h1-2,10H,(H,11,12)

synonyms
  • 3,5-DINITROSALICYLIC ACID
  • 609-99-4
  • 2-Hydroxy-3,5-dinitrobenzoic acid
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Properties
Property Value
MW 228.12 g/mol
HBD 2
HBA 7
Rotatable Bond Count 1
Exact Mass 228.00185047 g/mol
Monoisotopic Mass 228.00185047 g/mol
Heavy Atom Count 16
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 320
xlogp 1.3
Topological Polar Surface Area 149