2-heptenal

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 5
Total Number of Articles : 4
PubChem 5283316
Molecular Formula

C7H12O

SMILES

CCCC/C=C/C=O

InChI

InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3/b6-5+

synonyms
  • trans-2-Heptenal
  • (E)-Hept-2-enal
  • 18829-55-5
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Properties
Property Value
MW 112.17 g/mol
HBD 0
HBA 1
Rotatable Bond Count 4
Exact Mass 112.088815002 g/mol
Monoisotopic Mass 112.088815002 g/mol
Heavy Atom Count 8
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 74.5
xlogp 2.1
Topological Polar Surface Area 17.1