Molecule

ID:32037

General Information
Structure
MolImage
Molecular Formula
C₈H₂F₈
Molecular Mass
250.0887056
Exact Mass
250.00287582
Charge
0
InChI
InChI=1S/C8H2F8/c9-3-2(1-8(14,15)16)4(10)6(12)7(13)5(3)11/h1H2
InChIKey
AZSBRCDLVFIMRD-UHFFFAOYSA-N
Canonic Smiles
Fc1c(CC(F)(F)F)c(F)c(c(c1F)F)F
Isomeric Smiles
c1(c(c(c(c(c1CC(F)(F)F)F)F)F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.834907
LogD (pH = 7.4)
3.834907
Log P
3.834907
Molar Refractivity
37.5655
Polarizability
13.161311
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
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References
Bioactivity
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