Chemical ID: 4117417

c1cc(c(cc1CC(=O)O)F)F
Chemical ID:
4117417
Name [?]:
2-(3,4-difluorophenyl)acetic acid
SMILES [?]:
c1cc(c(cc1CC(=O)O)F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H6F2O2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:3.93302
Area:308.087
Solvation:-3.76915
Coulombic:-33.2374
Bond Count [?]
All:12
Single:8
Double:4
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:172.129
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.77
LogP (Chemaxon):1.96

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