Chemical ID: 4694548

COc1ccc(cc1)C2C(=C(C2=O)c3ccc(cc3)OC)O
Chemical ID:
4694548
Name [?]:
3-hydroxy-2,4-bis(4-methoxyphenyl)-cyclobut-2-en-1-one
SMILES [?]:
COc1ccc(cc1)C2C(=C(C2=O)c3ccc(cc3)OC)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H16O4
All Atoms:22
Heavy Atoms:22
Chiral Atoms:1
ZAP Information [?]
Total:6.99976
Area:505.931
Solvation:-5.64853
Coulombic:-38.5898
Bond Count [?]
All:24
Single:16
Double:8
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:296.317
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.97
LogP (Chemaxon):2.21

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