Diethylstilbestrol

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 614
Total Number of Articles : 840
PubChem 448537
Molecular Formula

C18H20O2

SMILES

CC/C(=C(/CC)\C1=CC=C(C=C1)O)/C2=CC=C(C=C2)O

InChI

InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+

synonyms
  • diethylstilbestrol
  • 56-53-1
  • Stilbestrol
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Properties
Property Value
MW 268.3 g/mol
HBD 2
HBA 2
Rotatable Bond Count 4
Exact Mass 268.146329876 g/mol
Monoisotopic Mass 268.146329876 g/mol
Heavy Atom Count 20
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 286
xlogp 5.1
Topological Polar Surface Area 40.5