Chemical ID: 4575077

COc1ccc(c(c1)OC)C=C2C(=O)c3ccc(cc3O2)OCC(=O)c4ccccc4
Chemical ID:
4575077
Name [?]:
2-[(2,4-dimethoxyphenyl)methylene]-6-phenacyloxy-benzofuran-3-one
SMILES [?]:
COc1ccc(c(c1)OC)C=C2C(=O)c3ccc(cc3O2)OCC(=O)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H20O6
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:8.74173
Area:650.367
Solvation:-7.51745
Coulombic:-47.679
Bond Count [?]
All:34
Single:22
Double:12
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:416.423
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.7
LogP (Chemaxon):3.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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