Molecule

ID:11993

General Information
Structure
MolImage
Molecular Formula
C₅H₂F₉I
Molecular Mass
359.9594788
Exact Mass
359.90575204
Charge
0
InChI
InChI=1S/C5H2F9I/c6-2(7,1-15)3(8,9)4(10,11)5(12,13)14/h1H2
InChIKey
HFCSJMGXADMMTI-UHFFFAOYSA-N
Canonic Smiles
ICC(C(C(C(F)(F)F)(F)F)(F)F)(F)F
Isomeric Smiles
C(I)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.124203
LogD (pH = 7.4)
4.124203
Log P
4.124203
Molar Refractivity
39.263
Polarizability
15.509206
Polar Surface Area
0.0
Rotatable Bonds
4
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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