Molecule

ID:93759

General Information
Structure
MolImage
Molecular Formula
C₈H₉F
Molecular Mass
124.1554632
Exact Mass
124.06882851
Charge
0
InChI
InChI=1S/C8H9F/c1-6-3-4-7(2)8(9)5-6/h3-5H,1-2H3
InChIKey
WJAVYWPXOXAOBS-UHFFFAOYSA-N
Canonic Smiles
Cc1ccc(c(c1)F)C
Isomeric Smiles
Fc1c(ccc(c1)C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.1427906
LogD (pH = 7.4)
3.1427906
Log P
3.1427906
Molar Refractivity
36.3568
Polarizability
13.505644
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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