Molecule

ID:9858

General Information
Structure
MolImage
Molecular Formula
C₂F₂O₂
Molecular Mass
94.0170064
Exact Mass
93.98663568
Charge
0
InChI
InChI=1S/C2F2O2/c3-1(5)2(4)6
InChIKey
HXQOOYKLTKQCRR-UHFFFAOYSA-N
Canonic Smiles
FC(=O)C(=O)F
Isomeric Smiles
O=C(F)C(=O)F
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
0.22772923
LogD (pH = 7.4)
0.22772923
Log P
0.22772923
Molar Refractivity
12.8856
Polarizability
4.76297
Polar Surface Area
34.14
Rotatable Bonds
1
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
References
Bioactivity
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