Molecule

ID:8191

General Information
Structure
MolImage
Molecular Formula
C₆F₅I
Molecular Mass
293.960686
Exact Mass
293.8964891
Charge
0
InChI
InChI=1S/C6F5I/c7-1-2(8)4(10)6(12)5(11)3(1)9
InChIKey
OPYHNLNYCRZOGY-UHFFFAOYSA-N
Canonic Smiles
Fc1c(F)c(F)c(c(c1F)I)F
Isomeric Smiles
c1(F)c(F)c(I)c(c(c1F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.6157
LogD (pH = 7.4)
3.6157
Log P
3.6157
Molar Refractivity
40.5025
Polarizability
15.300994
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
References
Bioactivity
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