Molecule

ID:15272

General Information
Structure
MolImage
Molecular Formula
C₆H₈F₅I
Molecular Mass
302.024206
Exact Mass
301.95908936
Charge
0
InChI
InChI=1S/C6H8F5I/c7-5(8,6(9,10)11)3-1-2-4-12/h1-4H2
InChIKey
LGOVMEORCBKCPY-UHFFFAOYSA-N
Canonic Smiles
ICCCCC(C(F)(F)F)(F)F
Isomeric Smiles
FC(C(CCCCI)(F)F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.9007163
LogD (pH = 7.4)
3.9007163
Log P
3.9007163
Molar Refractivity
43.884
Polarizability
16.699003
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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