Molecule

ID:99265

General Information
Structure
MolImage
Molecular Formula
C₆HF₄I
Molecular Mass
275.9702228
Exact Mass
275.90591091
Charge
0
InChI
InChI=1S/C6HF4I/c7-2-1-3(8)5(10)6(11)4(2)9/h1H
InChIKey
WCDGZBXJPUDDGP-UHFFFAOYSA-N
Canonic Smiles
Fc1cc(F)c(c(c1F)I)F
Isomeric Smiles
Ic1c(c(cc(c1F)F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.4729981
LogD (pH = 7.4)
3.4729981
Log P
3.4729981
Molar Refractivity
40.2861
Polarizability
15.263548
Polar Surface Area
0.0
Rotatable Bonds
0
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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