Molecule

ID:98728

General Information
Structure
MolImage
Molecular Formula
C₇H₃F₁₁
Molecular Mass
296.0811552
Exact Mass
296.00591052
Charge
0
InChI
InChI=1S/C7H3F11/c1-2(8)4(11,12)6(15,16)7(17,18)5(13,14)3(9)10/h3H,1H2
InChIKey
TZMIOVLJHRHMEY-UHFFFAOYSA-N
Canonic Smiles
FC(C(C(C(C(C(=C)F)(F)F)(F)F)(F)F)(F)F)F
Isomeric Smiles
FC(C(F)(C(F)(F)C(C(C(=C)F)(F)F)(F)F)F)F
Calculated Properties
JChem
Acid pKa
19.786564
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.9471018
LogD (pH = 7.4)
3.9471018
Log P
3.9471018
Molar Refractivity
34.4919
Polarizability
13.214037
Polar Surface Area
0.0
Rotatable Bonds
5
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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