Molecule

ID:8586

General Information
Structure
MolImage
Molecular Formula
C₇H₅FO
Molecular Mass
124.1124032
Exact Mass
124.032443
Charge
0
InChI
InChI=1S/C7H5FO/c8-7(9)6-4-2-1-3-5-6/h1-5H
InChIKey
HPMLGNIUXVXALD-UHFFFAOYSA-N
Canonic Smiles
FC(=O)c1ccccc1
Isomeric Smiles
O=C(F)c1ccccc1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.8765692
LogD (pH = 7.4)
1.8765692
Log P
1.8765692
Molar Refractivity
32.5377
Polarizability
11.933502
Polar Surface Area
17.07
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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