coumarin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 594
Total Number of Articles : 1013
PubChem 323
Molecular Formula

C9H6O2

SMILES

C1=CC=C2C(=C1)C=CC(=O)O2

InChI

InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H

synonyms
  • coumarin
  • 91-64-5
  • 2H-Chromen-2-one
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Properties
Property Value
MW 146.14 g/mol
HBD 0
HBA 2
Rotatable Bond Count 0
Exact Mass 146.036779430 g/mol
Monoisotopic Mass 146.036779430 g/mol
Heavy Atom Count 11
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 196
xlogp 1.4
Topological Polar Surface Area 26.3