Chemical ID: 5292624

CCc1ccc(cc1)C=C2C(=O)c3ccc(cc3O2)OCC(=O)OC
Chemical ID:
5292624
Name [?]:
methyl 2-[2-[(4-ethylphenyl)methylene]-3-oxo-benzofuran-6-yl]oxyacetate
SMILES [?]:
CCc1ccc(cc1)C=C2C(=O)c3ccc(cc3O2)OCC(=O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H18O5
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.14429
Area:558.255
Solvation:-4.81208
Coulombic:-44.4799
Bond Count [?]
All:27
Single:18
Double:9
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:338.354
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:4.15
LogP (Chemaxon):3.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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