Molecule

ID:12142

General Information
Structure
MolImage
Molecular Formula
C₄F₆O₂
Molecular Mass
194.0320192
Exact Mass
193.98024856
Charge
0
InChI
InChI=1S/C4F6O2/c5-1(11)3(7,8)4(9,10)2(6)12
InChIKey
KNURRSZDMIXZLO-UHFFFAOYSA-N
Canonic Smiles
FC(=O)C(C(C(=O)F)(F)F)(F)F
Isomeric Smiles
O=C(F)C(C(C(=O)F)(F)F)(F)F
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.6290146
LogD (pH = 7.4)
1.6290146
Log P
1.6290146
Molar Refractivity
22.2216
Polarizability
8.563693
Polar Surface Area
34.14
Rotatable Bonds
3
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
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Molecule Details
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References
Bioactivity
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