Chemical ID: 5277094

Cc1ccc(o1)C=C2C(=O)c3ccc(cc3O2)OCC(=O)OCc4ccccc4
Chemical ID:
5277094
Name [?]:
benzyl 2-[2-[(5-methyl-2-furyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetate
SMILES [?]:
Cc1ccc(o1)C=C2C(=O)c3ccc(cc3O2)OCC(=O)OCc4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H18O6
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:9.52487
Area:629.538
Solvation:-6.21359
Coulombic:-49.5168
Bond Count [?]
All:32
Single:21
Double:11
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:390.385
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.9
LogP (Chemaxon):3.39

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