Chemical ID: 5566844

Cc1ccc(cc1CCC(=O)O)C(C)C
Chemical ID:
5566844
Name [?]:
3-(5-isopropyl-2-methyl-phenyl)propanoic acid
SMILES [?]:
Cc1ccc(cc1CCC(=O)O)C(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H18O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.45001
Area:407.664
Solvation:-1.7416
Coulombic:-27.5156
Bond Count [?]
All:15
Single:11
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:206.281
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.46
LogP (Chemaxon):3.74

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