Molecule

ID:6541

General Information
Structure
Molecular Formula
C₄H₂F₆
Molecular Mass
164.0490992
Exact Mass
164.00606938
Charge
0
InChI
InChI=1S/C4H2F6/c5-3(6,7)1-2-4(8,9)10/h1-2H/b2-1+
InChIKey
NLOLSXYRJFEOTA-OWOJBTEDSA-N
Canonic Smiles
FC(/C=C/C(F)(F)F)(F)F
Isomeric Smiles
C(F)(F)(F)/C=C/C(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.608933
LogD (pH = 7.4)
2.608933
Log P
2.608933
Molar Refractivity
23.1878
Polarizability
7.6577
Polar Surface Area
0.0
Rotatable Bonds
2
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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