Nitroglycerin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 604
Total Number of Articles : 976
PubChem 4510
Molecular Formula

C3H5N3O9

SMILES

C(C(CO[N+](=O)[O-])O[N+](=O)[O-])O[N+](=O)[O-]

InChI

InChI=1S/C3H5N3O9/c7-4(8)13-1-3(15-6(11)12)2-14-5(9)10/h3H,1-2H2

synonyms
  • nitroglycerin
  • Glyceryl trinitrate
  • Trinitroglycerin
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Properties
Property Value
MW 227.09 g/mol
HBD 0
HBA 9
Rotatable Bond Count 5
Exact Mass 227.00257875 g/mol
Monoisotopic Mass 227.00257875 g/mol
Heavy Atom Count 15
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 219
xlogp 1.6
Topological Polar Surface Area 165