capillin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 7
Total Number of Articles : 3
PubChem 10321
Molecular Formula

C12H8O

SMILES

CC#CC#CC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H8O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h4,6-9H,1H3

synonyms
  • Capillin
  • 1-phenylhexa-2,4-diyn-1-one
  • 495-74-9
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Properties
Property Value
MW 168.19 g/mol
HBD 0
HBA 1
Rotatable Bond Count 2
Exact Mass 168.057514874 g/mol
Monoisotopic Mass 168.057514874 g/mol
Heavy Atom Count 13
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 306
xlogp 3
Topological Polar Surface Area 17.1