Molecule

ID:99491

General Information
Structure
MolImage
Molecular Formula
C₂H₄F₂O
Molecular Mass
82.0493664
Exact Mass
82.02302119
Charge
0
InChI
InChI=1S/C2H4F2O/c1-5-2(3)4/h2H,1H3
InChIKey
CGZAMBNIGLUBRY-UHFFFAOYSA-N
Canonic Smiles
COC(F)F
Isomeric Smiles
O(C)C(F)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
1.0513077
LogD (pH = 7.4)
1.0513077
Log P
1.0513077
Molar Refractivity
13.0214
Polarizability
4.9837446
Polar Surface Area
9.23
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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