4,6-dinitro-o-cresol

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 338
Total Number of Articles : 662
PubChem 10800
Molecular Formula

C7H6N2O5

SMILES

CC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3

synonyms
  • 2-Methyl-4,6-dinitrophenol
  • 4,6-DINITRO-O-CRESOL
  • DNOC
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Properties
Property Value
MW 198.13 g/mol
HBD 1
HBA 5
Rotatable Bond Count 0
Exact Mass 198.02767130 g/mol
Monoisotopic Mass 198.02767130 g/mol
Heavy Atom Count 14
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 245
xlogp 2.1
Topological Polar Surface Area 112