Chemical ID: 5789438

COC1C(Oc2ccccc2C1=O)c3ccc(cc3)O
Chemical ID:
5789438
Name [?]:
2-(4-hydroxyphenyl)-3-methoxy-chroman-4-one
SMILES [?]:
COC1C(Oc2ccccc2C1=O)c3ccc(cc3)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H14O4
All Atoms:20
Heavy Atoms:20
Chiral Atoms:2
ZAP Information [?]
Total:6.93009
Area:442.866
Solvation:-4.14156
Coulombic:-43.4874
Bond Count [?]
All:22
Single:15
Double:7
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:270.28
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.56
LogP (Chemaxon):2.41

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