Molecule

ID:32094

General Information
Structure
MolImage
Molecular Formula
C₁₀H₆F₈
Molecular Mass
278.1418656
Exact Mass
278.03417595
Charge
0
InChI
InChI=1S/C10H6F8/c1-8(11,12)5-2-6(9(13,14)15)4-7(3-5)10(16,17)18/h2-4H,1H3
InChIKey
PQQZRYQTIDELMW-UHFFFAOYSA-N
Canonic Smiles
CC(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(F)F
Isomeric Smiles
c1(cc(cc(c1)C(F)(F)F)C(C)(F)F)C(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.3660936
LogD (pH = 7.4)
4.3660936
Log P
4.3660936
Molar Refractivity
48.1112
Polarizability
16.69781
Polar Surface Area
0.0
Rotatable Bonds
3
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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