Chemical ID: 5179923

CC(=O)Oc1ccc(cc1OC(=O)C)C=CC(=O)O
Chemical ID:
5179923
Name [?]:
3-(3,4-diacetoxyphenyl)prop-2-enoic acid
SMILES [?]:
CC(=O)Oc1ccc(cc1OC(=O)C)C=CC(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H12O6
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.08695
Area:445.011
Solvation:-4.03833
Coulombic:-61.4234
Bond Count [?]
All:19
Single:12
Double:7
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:264.231
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:1.21
LogP (Chemaxon):1.15

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