Chemical ID: 5286944

c1cc(cc(c1)F)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccc5c(c4)OCO5
Chemical ID:
5286944
Name [?]:
[2-[(3-fluorophenyl)methylene]-3-oxo-benzofuran-6-yl] benzo[1,3]dioxole-5-carboxylate
SMILES [?]:
c1cc(cc(c1)F)C=C2C(=O)c3ccc(cc3O2)OC(=O)c4ccc5c(c4)OCO5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H13FO6
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:9.80623
Area:598.846
Solvation:-5.16491
Coulombic:-57.2945
Bond Count [?]
All:34
Single:22
Double:12
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:404.344
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:5.05
LogP (Chemaxon):4.38

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue