Ibuprofen

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 714
Total Number of Articles : 1035
PubChem 3672
Molecular Formula

C13H18O2

SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

InChI

InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)

synonyms
  • ibuprofen
  • 15687-27-1
  • Nurofen
Click to show/hide the synonyms
Properties
Property Value
MW 206.28 g/mol
HBD 1
HBA 2
Rotatable Bond Count 4
Exact Mass 206.130679813 g/mol
Monoisotopic Mass 206.130679813 g/mol
Heavy Atom Count 15
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 203
xlogp 3.5
Topological Polar Surface Area 37.3