Molecule
ID:12048
General Information
Molecular Formula
C₅H₂F₈
Molecular Mass
214.0566056
Exact Mass
214.00287582
Charge
0
InChI
InChI=1S/C5H2F8/c6-1-2(7)4(10,11)5(12,13)3(1,8)9/h1-2H
InChIKey
QVEJLBREDQLBKB-UHFFFAOYSA-N
Canonic Smiles
FC1C(F)C(C(C1(F)F)(F)F)(F)F
Isomeric Smiles
C1(C(C(C(C1(F)F)F)F)(F)F)(F)F
Calculated Properties
JChem
Acid pKa
18.30836
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.6234417
LogD (pH = 7.4)
2.6234417
Log P
2.6234417
Molar Refractivity
22.5448
Polarizability
9.22436
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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