Molecule

ID:93411

General Information
Structure
MolImage
Molecular Formula
C₁₂H₁₀AsF₆I
Molecular Mass
470.0242892
Exact Mass
469.89473864
Charge
0
InChI
InChI=1S/C12H10I.AsF6/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2-1(3,4,5,6)7/h1-10H;/q+1;-1
InChIKey
KFGZTBBPOZNSHA-UHFFFAOYSA-N
Canonic Smiles
c1ccc(cc1)[I+]c1ccccc1.F[As-](F)(F)(F)(F)F
Isomeric Smiles
[I+](c1ccccc1)c1ccccc1.[As-](F)(F)(F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.5634055
LogD (pH = 7.4)
4.5634055
Log P
4.5634055
Molar Refractivity
64.8948
Polarizability
28.086405
Polar Surface Area
0.0
Rotatable Bonds
2
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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