Molecule

ID:13776

General Information
Structure
MolImage
Molecular Formula
C₆F₃I₃
Molecular Mass
509.7728196
Exact Mass
509.70862866
Charge
0
InChI
InChI=1S/C6F3I3/c7-1-4(10)2(8)6(12)3(9)5(1)11
InChIKey
NTAZOPPTLZSXQH-UHFFFAOYSA-N
Canonic Smiles
Fc1c(I)c(F)c(c(c1I)F)I
Isomeric Smiles
c1(c(c(c(c(c1I)F)I)F)I)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.188185
LogD (pH = 7.4)
5.188185
Log P
5.188185
Molar Refractivity
66.7947
Polarizability
26.623146
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
false
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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