Chemical ID: 4561704

Cc1cc(cc(c1O)C(=O)O)Cc2cc(c(c(c2)C(=O)O)O)C
Chemical ID:
4561704
Name [?]:
5-[(3-carboxy-4-hydroxy-5-methyl-phenyl)methyl]-2-hydroxy-3-methyl-benzoic acid
SMILES [?]:
Cc1cc(cc(c1O)C(=O)O)Cc2cc(c(c(c2)C(=O)O)O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H16O6
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.79943
Area:508.238
Solvation:-4.90652
Coulombic:-86.3563
Bond Count [?]
All:24
Single:16
Double:8
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:316.305
H-Bond Donors:4
H-Bond Acceptors:6
XLogP:4.28
LogP (Chemaxon):4.82

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